SCHEMBL221679

SCHEMBL221679

O=C(O[C@](C(=O)O)(C(=O)c1ccccc1)[C@@H](O)C(=O)O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
LMNA P02545 2/20 0.41
F2 P00734 1/20 0.41
ALDH1A1 P00352 4/20 0.41
CES1 P23141 2/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 5/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
SRC P12931 1/20 0.37
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
KMT2A Q03164 3/20 0.35
MAPT P10636 3/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL27362899 1.00 TSHR (0.43) TSHRTP53LMNAF2ALDH1A1
SCHEMBL7686 1.00 TSHR (0.43) TSHRTP53LMNAF2ALDH1A1
SCHEMBL2904556 1.00 TSHR (0.43) TSHRTP53LMNAF2ALDH1A1
SCHEMBL223031 1.00 TSHR (0.43) TSHRTP53LMNAF2ALDH1A1
SCHEMBL1483657 1.00 TSHR (0.43) TSHRTP53LMNAF2ALDH1A1
SCHEMBL3946464 0.98 TSHR (0.42) TSHRTP53LMNAF2ALDH1A1
Water SCHEMBL1818831 0.98 TSHR (0.42) TSHRTP53LMNAF2ALDH1A1
Water SCHEMBL789812 0.98 TSHR (0.42) TSHRTP53LMNAF2ALDH1A1
Ammonia Solution, Strong SCHEMBL11444698 0.98 TSHR (0.42) TSHRTP53LMNAF2ALDH1A1
SCHEMBL11542849 0.98 TSHR (0.42) TSHRTP53LMNAF2ALDH1A1

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 2340 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122074028-A Heated aerosol-generating article for reducing malodour 菲利普莫里斯生产公司 2026-05-22 CN claimed
EP-4720073-A1 SOLID FORMS OF A MACROCYCLIC FARNESYLTRANSFERASE INHIBITOR AND FORMULATIONS THEREOF, AND METHODS OF PREPARING AND USING THE MACROCYCLIC COMPOUND AND ITS SOLID FORMS Kura Oncology, Inc. (US) 2026-04-08 EP claimed
US-20250270184-A1 PROCESSES FOR THE PREPARATION OF FINERENONE ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2025-08-28 US claimed
WO-2025133917-A1 PROCESS FOR THE PREPARATION OF (4S)-4-(4-CYANO-2-METHOXYPHENYL)-5- ETHOXY-1, 4-DIHYDRO-2,8-DIMETHYL-1,6-NAPTHYRIDINE-3-CARBOXAMIDE INDUSTRIALE CHIMICA S.R.L. (IT) 2025-06-26 WO claimed
US-12297567-B2 Composite nano-substance of cocoa-charcoal cladded conjugate structure and manufacturing method for yarn thereof CHANG SI RONG (TW) 2025-05-13 US claimed
US-20250115601-A1 PROCESS FOR THE PREPARATION OF FINERENONE AND INTERMEDIATES THEREOF ALIVUS LIFE SCIENCES LIMITED (IN) 2025-04-10 US claimed
US-20250100999-A1 METHODS AND INTERMEDIATES FOR PREPARING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2025-03-27 US claimed
EP-4526302-A1 PROCESS FOR THE PREPARATION OF FINERENONE AND INTERMEDIATES THEREOF Alivus Life Sciences Limited (IN) 2025-03-26 EP claimed
WO-2025056666-A1 HEATED AEROSOL-GENERATING ARTICLE FOR REDUCTION OF OFF-ODOUR PHILIP MORRIS PRODUCTS S.A. (CH) 2025-03-20 WO claimed
CN-119585268-A Process for preparing heteroaryl-ketone fused azadecalin glucocorticoid receptor modulators 科赛普特治疗公司 2025-03-07 CN claimed
WO-1992005171-A1 IMIDAZOLINE DERIVATIVES RECKITT & COLMAN PRODUCTS LIMITED (GB) 1992-04-02 WO claimed
EP-0438796-A2 Process for the enantioselection synthesis of alkylated oxindoles used as intermediates in the preparation of physostigmine HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-07-31 EP claimed
WO-1991004253-A1 PREPARATION OF S-(-)- AND R-(+)-N-(QUINUCLIDINYL-3)-AMIDE CHIRON LABORATORIES A.S (NO) 1991-04-04 WO claimed
EP-0420120-A2 Optically active benzyl alcohol compound and pharmaceutical composition HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1991-04-03 EP claimed
EP-0418770-A2 Process for the chemical resolution of 5-alkoxy-substituted (+/-)-1,3-dimethyloxindolylethylamines HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-03-27 EP claimed
EP-0107825-B1 1,3,4,6,7,11B-HEXAHYDRO-7-ARYL-2H-PYRAZINO (2,1-ALPHA) ISOQUINOLINES USEFUL AS INTERMEDIATES AND PHARMACEUTICAL COMPOUNDS AND METHODS OF PREPARATION PENNWALT CORPORATION (US) 1988-03-02 EP claimed
US-4458084-A Cyclopentene derivatives THE UPJOHN COMPANY (US) 1984-07-03 US claimed
EP-0107825-A1 1,3,4,6,7,11b-Hexahydro-7-aryl-2H-pyrazino (2,1-alpha) isoquinolines useful as intermediates and pharmaceutical compounds and methods of preparation PENNWALT CORPORATION (US) 1984-05-09 EP claimed
EP-0021923-B1 PROCESS FOR THE PREPARATION OF VINCAMINE DERIVATIVES SYNTHELABO (FR) 1983-09-07 EP claimed
US-4316029-A Synthesis of vincaminic acid derivatives SYNTHELABO (FR) 1982-02-16 US claimed