SCHEMBL2332638

SCHEMBL2332638

C=CC(CCC(=O)O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 4/20 0.46
CYP2D6 P10635 4/20 0.46
TSHR P16473 2/20 0.46
NFKB1 P19838 2/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
BLM P54132 1/20 0.46
SLC6A3 Q01959 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 1/20 0.44
CPA3 P15088 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
GGH Q92820 1/20 0.41
KEAP1 Q14145 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL17586724 0.88 TBXAS1 (0.49) CYP2C19CYP2D6TSHRSLC6A3ALDH1A1
SCHEMBL30937427 0.83 CYP2D6 (0.46) CYP2C19CYP2D6TSHRNFKB1SLC6A3
SCHEMBL3270768 0.81 FFAR1 (0.52) CYP2C19CYP2D6CPA3MAPK1GABBR2
SCHEMBL14071758 0.81 FFAR1 (0.52) CYP2C19CYP2D6CPA3MAPK1GABBR2
SCHEMBL27349633 0.80 FFAR1 (0.60) KMT2AALDH1A1KDM4EPOLBHSD17B10
SCHEMBL27797172 0.79 SMN1; SMN2 (0.48) CYP2C19CYP2D6MEN1KMT2AALDH1A1
SCHEMBL5560718 0.79 TRPA1 (0.44) CYP2C19ALDH1A1KDM4E
SCHEMBL7666339 0.79 CYP2C19 (0.48) CYP2C19CYP2D6TSHRNFKB1SLC6A3
SCHEMBL3804767 0.76 CYP2C19 (0.37) CYP2C19TSHRALDH1A1KDM4ECYP3A4
SCHEMBL3674189 0.76 CYP2D6 (0.54) CYP2C19CYP2D6TSHRNFKB1ALDH1A1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210055457-A1 COLOR FILTER MANUFACTURING METHOD, COLOR FILTER, AND RESIN COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2021-02-25 US disclosed
EP-3521874-B1 LIQUID CRYSTAL COMPOSITION, OPTICAL FILM, POLARIZING PLATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORP (JP) 2020-10-21 EP disclosed
EP-3521874-A1 LIQUID CRYSTAL COMPOSITION, OPTICAL FILM, POLARIZING PLATE, AND IMAGE DISPLAY DEVICE Fujifilm Corporation (JP) 2019-08-07 EP disclosed
US-20160075732-A1 RADICAL ORBITAL SWITCHING THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2016-03-17 US disclosed
US-20110198730-A1 HYPERBRANCHED POLYMER SYNTHESIZING METHOD, HYPERBRANCHED POLYMER, RESIST COMPOSITION, SEMICONDUCTOR INTEGRATED CIRCUIT, AND SEMICONDUCTOR INTEGRATED CIRCUIT FABRICATION METHOD LION CORPORATION 2011-08-18 US disclosed
US-7740996-B2 Photosensitive resin composition and color filter TOKYO OHKA KOGYO CO., LTD. (JP) 2010-06-22 US disclosed
US-20090023084-A1 PHOTOSENSITIVE RESIN COMPOSITION AND COLOR FILTER TOKYO OHKA KOGYO CO., LTD. (JP) 2009-01-22 US disclosed
US-6852662-B2 Catalyst systems based on transition metal complexes for carbon monoxide copolymerization in an aqueous medium BASF AKTIENGESELLSCHAFT (DE) 2005-02-08 US disclosed
US-20040092682-A1 Catalyst systems based on transition metal complexes for carbon monoxide copolymerization in an aqueous medium QUEISSER JOACHIM (DE) 2004-05-13 US disclosed
US-20040030040-A1 Method of producing aqueous copolymer dispersions from copolymers that comprise carbon monoxide and at least one olefinically unsaturated compound BASF AKTIENGESELLSCHAFT (DE) 2004-02-12 US disclosed
US-6673512-B1 PHOTORESISTS COMPRISING HOMO(CO)POLYCARBONS, ACID GENERATORS, CURING AGENTS AND BASES, USED TO FORM MINIATURIZED PATTERNS ON SEMICONDUCTORS USING X-RAYS OR RADIATION BEAMS; HIGH SENSITIVITY AND RESOLUTION FUJI PHOTO FILM CO., LTD. (JP) 2004-01-06 US disclosed
US-6670443-B1 Feeding ethylene in pulses BASF AKTIENGESELLSCHAFT (DE) 2003-12-30 US disclosed
US-6667386-B1 Linear, alternating copolymerization of carbon monoxide and alpha-olefins in aqueous media; constantly high average catalyst activity BASF AKTIENGESELLSCHAFT (DE) 2003-12-23 US disclosed
US-20030077543-A1 Positive resist composition FUJI PHOTO FILM CO., LTD. 2003-04-24 US disclosed
US-6541564-B2 Copolymerization of carbon monoxide and the olefinically unsaturated carried out in an aqueous medium in the presence of metal complexes, dispersant, organic hydroxy compound, wherein the soluble macromolecular host compound BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed
US-20020198359-A1 Priparation of copolymers of carbon monoxide and an olefinically unsaturated compound in an aqueous medium BASF AKIENGESELLSCHAFT (DE) 2002-12-26 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 (1 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-20160075732-A1 RADICAL ORBITAL SWITCHING RAD1, RAD54L, NQO1 CYP2C19 984/4885CYP2D6 607/4885TSHR 2182/4885

“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.