SCHEMBL136447

SCHEMBL136447

COC(=O)Cc1cc(B2OC(C)(C)C(C)(C)O2)ccc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.41
ROCK1 Q13464 1/20 0.41
HSD17B10 Q99714 1/20 0.40
DGAT1 O75907 1/20 0.40
HIF1A Q16665 4/20 0.40
AAK1 Q2M2I8 2/20 0.40
LIPG Q9Y5X9 2/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
LPL P06858 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36

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
SCHEMBL24410085 0.90 ROCK1 (0.43) CSF1RROCK1DGAT1HIF1AAAK1
SCHEMBL15272997 0.89 HIF1A (0.41) CSF1RROCK1DGAT1HIF1AAAK1
SCHEMBL17387588 0.88 HSD17B10 (0.55) CSF1RROCK1HSD17B10DGAT1HIF1A
SCHEMBL17939853 0.87 PDE4D (0.42) CSF1RROCK1DGAT1HIF1AAAK1
SCHEMBL16553724 0.87 DGAT1 (0.42) ROCK1HSD17B10DGAT1HIF1AAAK1
SCHEMBL13568196 0.85 HIF1A (0.43) CSF1RROCK1DGAT1HIF1AAAK1
SCHEMBL20562401 0.85 HIF1A (0.44) ROCK1DGAT1HIF1AAAK1LIPG
SCHEMBL30148596 0.85 CSF1R (0.40) CSF1RROCK1HSD17B10DGAT1HIF1A
SCHEMBL29743743 0.84 ROCK1 (0.41) ROCK1DGAT1HIF1AAAK1LIPG
SCHEMBL15866726 0.84 ROCK1 (0.48) ROCK1DGAT1HIF1AAAK1LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079745-A1 PYRAZOLONE COMPOUNDS AND USES THEREOF INCEPTION SCIENCES, INC. 2018-03-22 US disclosed
US-9862708-B2 Pyrazolone compounds and uses thereof TEMPEST THERAPEUTICS, INC. (US) 2018-01-09 US disclosed
US-9776976-B2 Triazolone compounds and uses thereof INCEPTION 2, INC. (US) 2017-10-03 US disclosed
US-20170174666-A1 PYRAZOLONE COMPOUNDS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2017-06-22 US disclosed
EP-2822931-B1 TRIAZOLONE COMPOUNDS AND USES THEREOF INCEPTION 2 INC (US) 2017-05-03 EP disclosed
EP-2822931-B1 TRIAZOLONE COMPOUNDS AND USES THEREOF INCEPTION 2 INC (US) 2017-05-03 EP disclosed
EP-3105205-A1 PYRAZOLONE COMPOUNDS AND USES THEREOF Inception 2, Inc. (US) 2016-12-21 EP disclosed
US-9505728-B2 Triazolone compounds and uses thereof INCEPTION 2, INC. (US) 2016-11-29 US disclosed
US-9505728-B2 Triazolone compounds and uses thereof INCEPTION 2, INC. (US) 2016-11-29 US disclosed
US-9505728-B2 Triazolone compounds and uses thereof INCEPTION 2, INC. (US) 2016-11-29 US disclosed
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-01-27 US disclosed
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-01-27 US disclosed
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-01-27 US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
WO-2009108720-A2 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-09-03 WO disclosed
WO-2009099902-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-10-28 US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 EP 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 (4 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-20170174666-A1 PYRAZOLONE COMPOUNDS AND USES THEREOF PPARA, PPARG, PPARD CSF1R 780/4885ROCK1 2057/4885HSD17B10 559/4885
US-20180079745-A1 PYRAZOLONE COMPOUNDS AND USES THEREOF PPARA, PPARG, PPARD CSF1R 603/4885ROCK1 2034/4885HSD17B10 846/4885
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 CSF1R 1667/4885ROCK1 2742/4885HSD17B10 1511/4885
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR CSF1R 491/4885ROCK1 3645/4885HSD17B10 341/4885

“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.