SCHEMBL3916599

SCHEMBL3916599

Ic1cccc(COc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.63
IDO1 P14902 2/20 0.58
F10 P00742 1/20 0.54
MAOB P27338 7/20 0.53
MAOA P21397 2/20 0.50
LCK P06239 1/20 0.50
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50
BCHE P06276 1/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
FFAR1 O14842 1/20 0.49
TACR1 P25103 1/20 0.49

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
SCHEMBL30674750 1.00 APP (0.63) APPIDO1F10MAOBMAOA
SCHEMBL5708187 0.98 APP (0.61) APPIDO1F10MAOBMAOA
SCHEMBL5708184 0.96 APP (0.59) APPIDO1F10MAOBMAOA
SCHEMBL314468 0.89 APP (0.63) APPMAOBMAOALCKCYP4F2
SCHEMBL1548932 0.86 F10 (0.62) APPF10MAOBMAOALCK
SCHEMBL5708191 0.85 APP (0.59) APPMAOBMAOALCKCYP4F2
SCHEMBL32665169 0.84 APP (0.59) APPF10MAOBMAOALCK
SCHEMBL9060683 0.84 APP (0.64) APPIDO1MAOBMAOA
Formaldehyde SCHEMBL27783224 0.84 NR4A2 (0.61) APPMAOBMAOALCKCYP4F2
SCHEMBL15761340 0.82 BCHE (0.70) APPF10MAOBMAOALCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250320227-A1 MACROCYCLIC OREXIN RECEPTOR AGONISTS AND USES THEREOF JAZZ PHARMACEUTICALS IRELAND LTD (IE) 2025-10-16 US disclosed
US-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-12 US disclosed
WO-2023232966-A1 MACROCYCLIC OREXIN RECEPTOR AGONISTS AND USES THEREOF JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2023-12-07 WO disclosed
US-20230159474-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS INCYTE CORPORATION 2023-05-25 US disclosed
US-11643399-B2 Modulators of mas-related G-protein receptor X4 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2023-05-09 US disclosed
CN-108774200-A The crystalline composites of compound, preparation method and its purposes for being used to prepare drug 贝林格尔·英格海姆维特梅迪卡有限公司 2018-11-09 CN disclosed
CN-104470908-A Crystalline complex of 1-cyano-2- (4-cyclopropyl-benzyl) -4- (beta-D-glucopyranos-1-yl) -benzene, method for preparing same and use thereof for preparing a medicament BOEHRINGER INGELHEIM VETMED 2015-03-25 CN disclosed
CN-102351918-B Glucopyranosyl-substituted benzonitrile derivatives and pharmaceutical compositions containing the same BOEHRINGER INGELHEIM INT 2015-03-04 CN disclosed
CN-104353077-A Pharmaceutical composition comprising a glucopyranosyl-substituted benzene derivative BOEHRINGER INGELHEIM INT 2015-02-18 CN disclosed
CN-104288166-A Pharmaceutical composition comprising a glucopyranosyl-substituted benzene derivative BOEHRINGER INGELHEIM INT 2015-01-21 CN disclosed
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US disclosed
EP-1706386-A1 BICYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-10-04 EP disclosed
US-20060205744-A1 Fused heterocyclic derivatives as ppar modulators ELI LILLY AND COMPANY PATENT DIVISION (US) 2006-09-14 US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
EP-1585726-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2005066136-A1 BICYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-07-21 WO disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed
US-6849649-B2 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC. (US) 2005-02-01 US disclosed
WO-2004063155-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed
US-6660756-B2 N-phenpropylcyclopentyl-substituted glutaramide derivatives as inhibitors of neutral endopeptidase PFIZER INC. 2003-12-09 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 (5 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-11840521-B2 Modulators of Mas-related G-protein receptor X4 and related products and methods MRGPRX4, MRGPRX1, MRGPRX2 APP 3135/4885IDO1 4127/4885F10 1040/4885
US-20060205744-A1 Fused heterocyclic derivatives as ppar modulators PPARA, PPARG, PPARD APP 4140/4885IDO1 4005/4885F10 2362/4885
US-11643399-B2 Modulators of mas-related G-protein receptor X4 and related products and methods MRGPRX4, MRGPRX1, MRGPRX2 APP 3135/4885IDO1 4127/4885F10 1040/4885
US-20230159474-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X4 AND RELATED PRODUCTS AND METHODS MRGPRX4, MRGPRX1, MRGPRX2 APP 3135/4885IDO1 4127/4885F10 1040/4885
US-20250320227-A1 MACROCYCLIC OREXIN RECEPTOR AGONISTS AND USES THEREOF HCRTR1, HCRTR2, NPY1R APP 420/4885IDO1 1116/4885F10 1115/4885

“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.