SCHEMBL6864579

SCHEMBL6864579

Nc1ccc(Cc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
ALDH1A1 P00352 3/20 0.61
CYP3A4 P08684 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
SRD5A2 P31213 4/20 0.58
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
PLA2G10 O15496 1/20 0.53
PLA2G2A P14555 1/20 0.53
TP53 P04637 1/20 0.52
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.48
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
ANPEP P15144 1/20 0.47
ENPEP Q07075 1/20 0.47

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
SCHEMBL68390 0.89 SRD5A2 (0.69) TSHRALDH1A1SRD5A2CA12CA1
SCHEMBL900338 0.87 GFER (0.61) TSHRALDH1A1SRD5A2TP53KMT2A
Hydrochloric Acid SCHEMBL25188150 0.86 SRD5A2 (0.67) TSHRALDH1A1SRD5A2CA12CA1
Hydrochloric Acid SCHEMBL7133360 0.86 SRD5A2 (0.67) TSHRALDH1A1SRD5A2CA12CA1
Terephthalic Acid SCHEMBL9717815 0.86 TSHR (0.71) TSHRALDH1A1TDP1SRD5A2CA12
Aminobenzoic Acid SCHEMBL1768920 0.86 TSHR (0.71) TSHRALDH1A1TDP1SRD5A2CA12
Terephthalic Acid SCHEMBL7648718 0.86 TSHR (0.71) TSHRALDH1A1TDP1SRD5A2CA12
Aminobenzoic Acid SCHEMBL8249 0.86 TSHR (0.71) TSHRALDH1A1TDP1SRD5A2CA12
SCHEMBL16852605 0.86 ALDH1A1 (0.54) TSHRALDH1A1CYP3A4TDP1SRD5A2
Aminomethylbenzoic Acid SCHEMBL5781145 0.85 LOXL2 (0.62) TSHRALDH1A1TDP1SRD5A2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391699-A Containing an aromatic amine carboxylate, heat resistance BRIDGESTONE CORPORATION (JP) 1995-02-21 US claimed
EP-0571095-A2 Polyester copolymer and process for the production of the same BRIDGESTONE CORPORATION (JP) 1993-11-24 EP claimed
US-4045417-A POLYMERIZATION IN PRESENCE OF A TERTIARY AMINE, A PHOSPHORUS COMPOUND, AND A METAL HALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-30 US claimed
WO-2023196898-A1 BETA GLOBIN MIMETIC PEPTIDES AND THEIR USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO disclosed
US-8920766-B2 Quantum nanostructures, compositions thereof, and methods of making and using same UNIVERSITY OF ROCHESTER (US) 2014-12-30 US disclosed
US-20140170692-A1 QUANTUM NANOSTRUCTURES, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING SAME NATIONAL SCIENCE FOUNDATION 2014-06-19 US disclosed
US-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed
US-5391699-A Containing an aromatic amine carboxylate, heat resistance BRIDGESTONE CORPORATION (JP) 1995-02-21 US disclosed
EP-0571095-A2 Polyester copolymer and process for the production of the same BRIDGESTONE CORPORATION (JP) 1993-11-24 EP disclosed
US-4758651-A Amorphous aromatic copolyamide, a process for the preparation thereof, and shaped object AKZO NV (NL) 1988-07-19 US disclosed
US-4299945-A HEAT POLYMERIZATION OF AN AROMATIC DIAMINO COMPOUND AND AN AROMATIC TRIBASIC CARBOXYLIC ACID TORAY INDUSTRIES, INC. (JP) 1981-11-10 US disclosed
EP-0017422-A1 Thermoplastic polyamideimide copolymers and method of preparation TORAY INDUSTRIES, INC. (JP) 1980-10-15 EP disclosed
US-4173563-A PEPTIDIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-11-06 US disclosed
US-4120853-A Esterification of carboxylic acids by contact with a phosphonium salt SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-10-17 US disclosed
US-4118374-A PHOSPHITE, TERTIARY AMINE, LITHIUM OR CALCIUM HALIDE IN N-METHYLPYRROLIDONE OR DIMETHYLACETAMIDE AS POLYCONDENSATION SOLVENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-10-03 US disclosed
US-4059603-A Esterification of carboxylic acids by contact with a phosphonium salt SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-11-22 US disclosed
US-4045417-A POLYMERIZATION IN PRESENCE OF A TERTIARY AMINE, A PHOSPHORUS COMPOUND, AND A METAL HALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-30 US disclosed
US-3974219-A PREPARATION PEPTIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-08-10 US disclosed
US-3932364-A DIHYDROCARBYL PHOSPHITE AND A PYRIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-13 US disclosed