SCHEMBL5179130

SCHEMBL5179130

O=C(O)CCCC(=O)c1cccs1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.90
ALDH1A1 P00352 4/20 0.71
LMNA P02545 2/20 0.71
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
NPC1 O15118 2/20 0.71
RAB9A P51151 2/20 0.71
POLB P06746 1/20 0.71
HDAC1 Q13547 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.57
PKM P14618 1/20 0.57
TSHR P16473 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
HSD17B10 Q99714 1/20 0.57
CTNNB1 P35222 6/20 0.57
WNT3A P56704 5/20 0.57
GSK3B P49841 1/20 0.56
ERCC5 P28715 1/20 0.56
FEN1 P39748 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2415331 0.96 HPGD (0.96) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL5179083 0.95 HPGD (1.00) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL3383085 0.95 HPGD (1.00) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL22721189 0.92 ALDH1A1 (0.83) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL759462 0.89 ALDH1A1 (0.84) HPGDALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL1373347 0.87 ALDH1A1 (0.81) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL1476817 0.85 KMT2A (0.71) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL2216212 0.84 ALDH1A1 (1.00) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL18906067 0.83 ALDH1A1 (0.74) HPGDALDH1A1LMNAMEN1KMT2A
SCHEMBL3176357 0.81 LMNA (0.71) HPGDALDH1A1LMNAMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11269251-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-03-08 US disclosed
US-10844050-B2 Cyclization processes of hydroxyalkenoic acids and products thereof YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2020-11-24 US disclosed
US-20200048233-A1 CYCLIZATION PROCESSES OF HYDROXYALKENOIC AICDS AND PRODUCTS THEREOF Yissum Research Development Company, of The Hebrew University of Jerusalem Ltd. (IL) 2020-02-13 US disclosed
US-20190113844-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-04-18 US disclosed
WO-2018150421-A1 CYCLIZATION PROCESSES OF HYDROXYALKENOIC AICDS AND PRODUCTS THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2018-08-23 WO disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
EP-1245605-B1 Polyhydroxyalkanoate containing unit with thienyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain this polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KK (JP) 2007-03-14 EP disclosed
US-7115741-B2 4-thieno[2,3-D]pyrimidin-4-YL piperazine compounds ALEXION PHARMACEUTICALS, INC. 2006-10-03 US disclosed
US-7045321-B2 POLYHYDROXYALKANOATE CONTAINING UNIT WITH PHENYLSULFANYL STRUCTURE IN THE SIDE CHAIN, PROCESS FOR ITS PRODUCTION, CHARGE CONTROL AGENT, TONER BINDER AND TONER WHICH CONTAIN NOVEL POLYHYDROXYALKANOATE, AND IMAGE-FORMING METHOD AND IMAGE-FORMING APPARATUS WHICH MAKE USE OF THE TONER CANON KABUSHIKI KAISHA (JP) 2006-05-16 US disclosed
US-6777153-B2 POLYLACTONES FOR ELECTROSTATIC LATENT IMAGING PRODUCED WITH MICROORGANISM (PSEUDOMONAS) CULTURE CANON KABUSHIKI KAISHA (JP) 2004-08-17 US disclosed
US-20030153556-A1 Piperazine and homopiperazine compounds MILLENNIUM PHARMACEUTICALS, INC. 2003-08-14 US disclosed
US-20030096182-A1 Polyhydroxyalkanoate containing unit with thienyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain this polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2003-05-22 US disclosed
WO-2003022214-A2 PIPERAZINE AND HOMOPIPERAZINE COMPOUNDS MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-03-20 WO disclosed
EP-1245605-A2 Polyhydroxyalkanoate containing unit with thienyl structure in the side chain, process for its production, charge control agent, toner binder and toner which contain this polyhydroxyalkanoate, and image-forming method and image-forming apparatus which make use of the toner CANON KABUSHIKI KAISHA (JP) 2002-10-02 EP disclosed
US-6372883-B1 FOR THERAPY AND PROPHYLAXIS OF INFECTIONS CAUSED BY HEPATITIS C, HEPATITIS G AND HUMAN GB VIRUSES HOFFMANN-LA ROCHE INC. 2002-04-16 US disclosed
EP-0221806-B1 SUBSTITUTED THIOPHENE-2-SULFANOMIDE AND ANTIGLAUCOMA COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1990-01-10 EP disclosed
EP-0221806-A1 Substituted thiophene-2-sulfanomide and antiglaucoma compositions containing them MERCK & CO. INC. (US) 1987-05-13 EP disclosed
US-4665090-A TOPICAL ADMINISTRATION MERCK & CO., INC. (US) 1987-05-12 US disclosed
US-4058529-A Polycyclic amino derivatives of pyrrolidone and piperidone CIBA-GEIGY CORPORATION (US) 1977-11-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030153556-A1 Piperazine and homopiperazine compounds HAMP, MPL, F2 HPGD 119/4885ALDH1A1 3346/4885LMNA 4352/4885
US-10844050-B2 Cyclization processes of hydroxyalkenoic acids and products thereof FASN, ALOX5, HACL2 HPGD 113/4885ALDH1A1 387/4885LMNA 2804/4885
US-20200048233-A1 CYCLIZATION PROCESSES OF HYDROXYALKENOIC AICDS AND PRODUCTS THEREOF FADS2, FASN, ACADM HPGD 95/4885ALDH1A1 188/4885LMNA 3698/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.