SCHEMBL176645

SCHEMBL176645

N[C@@H](CO)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.50
SCN4A P35499 2/20 0.50
F2 P00734 1/20 0.50
HTR2A P28223 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
TRPA1 O75762 2/20 0.45
ADRA2A P08913 1/20 0.44
ADRA2C P18825 1/20 0.44

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
SCHEMBL30559582 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
SCHEMBL101141 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
SCHEMBL101140 1.00 DPP4 (0.50) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL20972918 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Ammonia Solution, Strong SCHEMBL13737655 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL19554902 0.97 SCN4A (0.48) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL30450135 0.95 GRIN2D (0.47) DPP4SCN4AF2HTR2ATAAR1
Hydrochloric Acid SCHEMBL30450281 0.95 GRIN2D (0.47) DPP4SCN4AF2HTR2ATAAR1
Isopropyl Alcohol SCHEMBL4065314 0.91 KDM4E (0.54) TAAR1TRPA1ADRA2AADRA2C
Phenol SCHEMBL28231638 0.91 CA12 (0.48) DPP4SCN4AF2GRIN2DGRIN3B

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

Appears in 2357 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133248-A1 DIASTEREOMERIC AMINOALCOHOL AND AMINOETHER SALTS OF 2-[(4R,S)-8-FLUORO-2-[4-(3-METHOXYPHENYL)PIPERAZIN-1-YL]-3-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDROQUINAZOLIN-4-YL]ACETIC ACID AND THEIR USE FOR ENANTIOMERIC SEPARATION AIC246 AG & CO. KG (DE) 2025-06-26 WO claimed
EP-3694864-B1 BORONIC ACID DERIVATIVES AND SYNTHESIS THEREOF QPEX BIOPHARMA INC (US) 2025-03-05 EP claimed
WO-2025019172-A1 ANTIMICROBIAL EXTRACTANT FORMED FROM COPPER-CONTAINING SOURCE CORNING INCORPORATED (US) 2025-01-23 WO claimed
CN-118415169-A Application of (R) - (-) -2-phenylglycinol in preventing and controlling root-knot nematode 江西省农业科学院农业应用微生物研究所(江西省农村能源研究中心) 2024-08-02 CN claimed
US-11845729-B2 Processes and intermediates in the preparation of C5aR antagonists CHEMOCENTRYX, INC. (US) 2023-12-19 US claimed
US-20230008966-A1 PROCESSES AND INTERMEDIATES IN THE PREPARATION OF C5aR ANTAGONISTS CHEMOCENTRYX, INC. 2023-01-12 US claimed
EP-3682879-B1 PROCESSES AND INTERMEDIATES IN THE PREPARATION OF C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2022-08-03 EP claimed
US-11286270-B2 Boronic acid derivatives and synthesis thereof QPEX BIOPHARMA, INC. (US) 2022-03-29 US claimed
CN-106999481-B Processes and intermediates for preparing C5aR antagonists 凯莫森特里克斯股份有限公司 2021-04-16 CN claimed
US-20200407373-A1 BORONIC ACID DERIVATIVES AND SYNTHESIS THEREOF QPEX BIOPHARMA, INC. 2020-12-31 US claimed
EP-1064255-A1 A PROCESS FOR THE MANUFACTURE OF (2S,2'R,3'R)-2-(2,3-DICARBOXYLCYCLOPROPYL)-GLYCINE F. HOFFMANN-LA ROCHE AG (CH) 2001-01-03 EP claimed
CN-1268947-A Novel process for preparing 4-hydroxy-2-oxo-pyran derivatives as protease inhibitors UPJOHN CO (US) 2000-10-04 CN claimed
EP-1015441-A1 PROCESS TO PRODUCE 4-HYDROXY-2-OXO-PYRANE DERIVATIVES USEFUL AS PROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-05 EP claimed
EP-0987332-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINO COMPOUNDS Kaneka Corporation (JP) 2000-03-22 EP claimed
US-6020525-A (2S,2'R,3'R)-2-(2,3-dicarboxyl-cyclopropyl)-glycine (DCG-1/4) and 3 H-DCG-1/4 and to process for the preparation thereof HOFFMANN-LA ROCHE INC. (US) 2000-02-01 US claimed
WO-1999047489-A1 A PROCESS FOR THE MANUFACTURE OF (2S,2'R,3'R)-2-(2,3-DICARBOXYLCYCLOPROPYL)-GLYCINE F. HOFFMANN-LA ROCHE AG (CH) 1999-09-23 WO claimed
WO-1999012919-A1 PROCESS TO PRODUCE 4-HYDROXY-2-OXO-PYRANE DERIVATES USEFUL AS PROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-03-18 WO claimed
EP-0874847-A1 NOVEL PURINE DERIVATIVES HAVING, IN PARTICULAR, ANTIPROLIFERATIVE PROPERTIES, AND BIOLOGICAL USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-11-04 EP claimed
EP-0857790-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINO COMPOUNDS KANEKA CORPORATION (JP) 1998-08-12 EP claimed
WO-1997020842-A1 NOVEL PURINE DERIVATIVES HAVING, IN PARTICULAR, ANTIPROLIFERATIVE PROPERTIES, AND BIOLOGICAL USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 1997-06-12 WO claimed