SCHEMBL4071095

SCHEMBL4071095

CCC(C(=O)O)c1ccccc1O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
LMNA P02545 2/20 0.45
HSD17B10 Q99714 2/20 0.45
HPGD P15428 2/20 0.43
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
AKR1B1 P15121 1/20 0.39
PTGS1 P23219 2/20 0.39
CYP1A2 P05177 1/20 0.39
PTGS2 P35354 1/20 0.39
AKR1C3 P42330 3/20 0.38
AKR1C2 P52895 3/20 0.38
AKR1C1 Q04828 1/20 0.38

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
SCHEMBL6773227 1.00 TSHR (0.57) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL30483161 1.00 TSHR (0.57) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL22383428 0.85 TSHR (0.48) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL8015528 0.85 TSHR (0.48) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL9098490 0.85 BCHE (0.49) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL10627436 0.84 TSHR (0.45) TSHRGABRA1GABRB2LMNAHPGD
SCHEMBL10515048 0.83 TSHR (0.55) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL2517311 0.82 TSHR (0.46) TSHRGABRA1GABRB2LMNAHSD17B10
SCHEMBL1928791 0.81 ACP3 (0.43) TSHRLMNAHSD17B10HPGDALDH1A1
SCHEMBL10580121 0.81 LMNA (0.41) TSHRLMNAHSD17B10POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107311857-A (2 hydroxy phenyl) butyric acid of 4 hydroxyls of R 2 and its preparation and application 云南农业大学 2017-11-03 CN claimed
CN-101380317-B Pharmaceutical composition for relieving pruritus CAYMAN ISLAND SHANGANSHENG DEV PHARMACEUTICAL CO LTD 2010-12-08 CN claimed
EP-2033635-A1 Short-chain fatty acid derivatives for treating pruritus Asan Laboratories Company (Cayman) Limited (CN) 2009-03-11 EP claimed
CN-101380317-A Pharmaceutical composition for relieving pruritus CAYMAN ISLAND SHANGANSHENG DEV (CN) 2009-03-11 CN claimed
US-20080107646-A1 Administering phenylbutyric acid derivative and pharmaceutically acceptable carrier Sunny Pharmtech Inc. (TW) 2008-05-08 US claimed
US-6403646-B1 ADMINISTERING PHENYLBUTYRIC ACID OR DERIVATIVES TO TREAT LIVER DISEASE AND EMPHYSEMA CAUSED BY PROTEASE INHIBITOR TYPE Z MUTATION; STIMULATES SECRETION WITHOUT INCREASING SYNTHESIS OF PROTEIN PERLMUTTER DAVID H (US) 2002-06-11 US claimed
JP-2119785-A None JP disclosed
US-12295394-B2 Water-soluble additive composition SUMITOMO BAKELITE CO., LTD. (JP) 2025-05-13 US disclosed
WO-2025025245-A1 LIGHT-EMITTING DEVICE, PREPARATION METHOD, AND ELECTRONIC APPARATUS 纳晶科技股份有限公司 2025-02-06 WO disclosed
WO-2025025244-A1 LIGHT-EMITTING APPARATUS, PREPARATION METHOD AND ELECTRONIC DEVICE 纳晶科技股份有限公司 2025-02-06 WO disclosed
CN-117777396-A Heat-sealable aqueous resin composition and laminate 荒川化学工业株式会社 2024-03-29 CN disclosed
CN-115725231-A Water-based composition for barrier and laminate 荒川化学工业株式会社 2023-03-03 CN disclosed
CN-115450067-A Water-based oil proofing agent and oil-resistant paper 荒川化学工业株式会社 2022-12-09 CN disclosed
WO-1993002037-A1 ARYLAMIDOALKYL-N-HYDROXYUREA COMPOUNDS HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LABORATORIES (US) 1993-02-04 WO disclosed
JP-H02119785-A PRODUCTION OF 2-OXO-4-PHENYLBUTYRIC ACID TORAY IND INC 1990-05-07 JP disclosed
US-4761420-A CARDIOVASCULAR DISORDERS LABORATOIRES SYNTEX S.A. (FR) 1988-08-02 US disclosed
EP-0249245-A2 Antihypertensive dihydropyridine derivatives LABORATOIRES SYNTEX S.A. (FR) 1987-12-16 EP disclosed
US-4112160-A NITRILE RUBBER, PHENOLIC RESIN SUMITOMO DUREZ COMPANY, LTD. (JP) 1978-09-05 US disclosed
US-4054712-A ELECTROGRAPHY CANON KABUSHIKI KAISHA (JA) 1977-10-18 US disclosed
US-4007233-A NITRILE RUBBER, PHENOLIC RESIN SUMITOMO DUREZ COMPANY, LTD. (JA) 1977-02-08 US disclosed