SCHEMBL177455

SCHEMBL177455

Cc1ccc(OBOc2ccc(C)c(Cl)c2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.45
▸ DRD2 P14416 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ RAPGEF4 Q8WZA2 1/20 0.36
▸ MAPT P10636 6/20 0.34
▸ HPGD P15428 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34

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
SCHEMBL19886444 0.83 CYP3A4 (0.42) CYP3A4DRD2DRD4DRD3SLC6A4
SCHEMBL177406 0.83 MCL1 (0.49) SLC6A4HTR2AKCNH2SMN1; SMN2MAPT
SCHEMBL177501 0.79 HSP90AA1 (0.47) CYP3A4SLC6A4HTR2AKCNH2SMN1; SMN2
SCHEMBL29804592 0.79 TDP1 (0.44) DRD2DRD4DRD3SLC6A4HTR2A
SCHEMBL14396803 0.79 HTR2A (0.51) CYP3A4DRD2DRD4DRD3SLC6A4
SCHEMBL177356 0.79 TDP1 (0.44) DRD2DRD4DRD3SLC6A4HTR2A
SCHEMBL2205828 0.77 MAPT (0.50) CYP3A4DRD2DRD4DRD3SLC6A4
SCHEMBL3755105 0.76 CYP3A4 (0.46) CYP3A4DRD2DRD4DRD3SLC6A4
SCHEMBL177471 0.75 CA12 (0.43) SLC6A4SMN1; SMN2MAPTHPGDNPC1
SCHEMBL25798448 0.74 CYP3A4 (0.45) CYP3A4DRD2DRD4DRD3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024129780-A1 BENZIMIDAZOLE DERIVATIVES AS GPX4 INHIBITORS SONATA THERAPEUTICS, INC. (US) 2024-06-20 — — WO disclosed
CN-118184710-A Organic electroluminescent material and device 环球展览公司 2024-06-14 — — CN disclosed
CN-118084982-A Organic electroluminescent material and device 环球展览公司 2024-05-28 — — CN disclosed
CN-118084983-A Organic electroluminescent material and device 环球展览公司 2024-05-28 — — CN disclosed
CN-117801024-A Organic electroluminescent material and device 环球展览公司 2024-04-02 — — CN disclosed
CN-107522747-B Organic electroluminescent material and device 环球展览公司 2024-03-05 — — CN disclosed
CN-107522749-B Organic electroluminescent material and device 环球展览公司 2024-03-05 — — CN disclosed
CN-107522748-B Organic electroluminescent material and device 环球展览公司 2024-01-09 — — CN disclosed
CN-116568677-A piperidin-1-yl-N-pyridin-3-yl-2-oxoacetamide derivatives useful for the treatment of MTAP deficiency and/or MTA accumulating cancers 探戈医药股份有限公司 2023-08-08 — — CN disclosed
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 — — CN disclosed
US-8329675-B2 Inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2012-12-11 — — US disclosed
EP-2404607-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2012-01-11 — — EP disclosed
EP-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
EP-2399584-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
US-20110230440-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE ADAMS JULIAN 2011-09-22 — — US disclosed
US-20110224171-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY DISCOVERY, INC. 2011-09-15 — — US disclosed
EP-2073816-B1 BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS INC (US) 2011-09-14 — — EP disclosed
US-7645773-B2 Thiazoles as inhibitors of 11β-hydroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2010-01-12 — — US disclosed
EP-2073816-A2 INHIBITORS OF FATTY ACID AMIDE HYDROLASE Infinity Pharmaceuticals, Inc. (US) 2009-07-01 — — EP disclosed
WO-2008063300-A2 BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS, INC. (US) 2008-05-29 — — WO 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 (2 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-20110224171-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 CYP3A4 1007/4885DRD2 2253/4885DRD4 3365/4885
US-20110230440-A1 INHIBITORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, ASAH1 CYP3A4 1007/4885DRD2 2253/4885DRD4 3365/4885

“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.

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