SCHEMBL5510171

SCHEMBL5510171

COOC(=O)c1ccccc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.49
KMT2A Q03164 7/20 0.46
MEN1 O00255 5/20 0.46
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
LMNA P02545 3/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 1/20 0.44
ALDH1A1 P00352 3/20 0.44
PLK1 P53350 1/20 0.44
PLK2 Q9NYY3 1/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL127127 0.89 NPC1 (0.53) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL27865356 0.87 TSHR (0.58) TSHRNPC1KMT2ALMNAMAPT
Propylene Oxide SCHEMBL27807203 0.87 BCHE (0.43) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL27301503 0.84 MEN1 (0.47) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL101601 0.83 TSHR (0.63) TSHRNPC1RAB9AKMT2ALMNA
SCHEMBL29702037 0.83 TSHR (0.63) TSHRNPC1RAB9AKMT2ALMNA
SCHEMBL23231964 0.82 ALDH1A1 (0.58) NPC1RAB9AKMT2AMAPTHPGD
SCHEMBL15768394 0.82 TSHR (0.55) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL7629352 0.82 NPC1 (0.47) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL13355960 0.82 NPC1 (0.47) TSHRNPC1RAB9AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9809822-B2 Triptolide derivatives and preparation method and use thereof HONG KONG BAPTIST UNIVERSITY (HK) 2017-11-07 US claimed
CN-116096765-B Curable composition 株式会社LG化学 2024-12-13 CN disclosed
CN-117940522-A Curable composition, protective film, optical element, and liquid crystal display device 株式会社LG化学 2024-04-26 CN disclosed
CN-114409630-B Pharmaceutical compositions comprising oxoisoindole compounds and methods of using the same 细胞基因公司 2024-04-02 CN disclosed
CN-116745295-A BRM targeting compounds and related methods of use 普莱鲁德疗法有限公司 2023-09-12 CN disclosed
CN-110869021-B Antiproliferative compounds and methods of use thereof 细胞基因公司 2023-06-30 CN disclosed
CN-116096765-A Curable composition 株式会社LG化学 2023-05-09 CN disclosed
WO-2022255400-A1 CLEANER FOR INDOOR WATER USE SITES 住友化学株式会社 2022-12-08 WO disclosed
CN-114404596-A Antiproliferative compounds and second agents for the treatment of multiple myeloma 细胞基因公司 2022-04-29 CN disclosed
CN-114409630-A Pharmaceutical compositions comprising oxoisoindole compounds and methods of using the same 细胞基因公司 2022-04-29 CN disclosed
EP-2766336-A1 PROCESS FOR PREPARING ALKOXY ARYL ESTER Saudi Basic Industries Corporation (SA) 2014-08-20 EP disclosed
US-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 US disclosed
WO-2013053455-A1 PROCESS FOR PREPARING ALKOXY ARYL ESTER SAUDI BASIC INDUSTRIES CORPORATION (SABIC) (SA) 2013-04-18 WO disclosed
EP-1846395-A1 PYRAZOLE DERIVATIVES FOR THE INHIBITION OF CDK'S AND GSK'S Astex Therapeutics Limited (GB) 2007-10-24 EP disclosed
WO-2006077414-A1 PYRAZOLE DERIVATIVES FOR THE INHIBITION OF CDK' S AND GSK' S ASTEX THERAPEUTICS LIMITED (GB) 2006-07-27 WO disclosed
CN-1128783-C Process for distillation of crude ester in DMT/PTA process DEGUSSA (DE) 2003-11-26 CN disclosed
US-5859143-A BLOCK COPOLYMERIZATION REACTION IN PRESENCE OF HYDROGEN AND STEREOSPECIFIC CATALYST CONTAINING COMPOUNDS OF MAGNESIUM, TITANIUM, HALOGEN, ORGANOALUMINUM AND ELECTRON DONOR MITSUBISHI CHEMICAL CORPORATION (JP) 1999-01-12 US disclosed
CN-1176847-A Catalyst and method for catalytic off-gas cleaning in DMT process HUELS CHEMISCHE WERKE AG (DE) 1998-03-25 CN disclosed
CN-1172101-A Process for distillation of crude ester in DMT/PTA process HUELS CHEMISCHE WERKE AG (DE) 1998-02-04 CN disclosed
US-4542189-A Process for the preparation of novel rubber-modified thermoplastic resin compositions using multiple feed streams THE STANDARD OIL COMPANY (US) 1985-09-17 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-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION PYGM, CKMT1A; CKMT1B, SMN1; SMN2 TSHR 4310/4885NPC1 3613/4885RAB9A 3488/4885

“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.