SCHEMBL7780129

SCHEMBL7780129

Cc1c(C(C)(C)C)cc(C(C)(C)C)c(O)c1C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.78
GLRB P48167 1/20 0.78
SMN1; SMN2 Q16637 4/20 0.47
CA2 P00918 3/20 0.47
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.47
TYR P14679 1/20 0.47
LDHA P00338 3/20 0.46
LDHB P07195 3/20 0.46
CA1 P00915 2/20 0.43
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
CYP1A2 P05177 1/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GABBR2 O75899 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41
ALOX5 P09917 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL9342070 0.98 GLRA3 (0.75) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
Water SCHEMBL9341160 0.96 GLRA3 (0.72) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL30861725 0.88 GLRA3 (0.63) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL2791325 0.88 GLRA3 (1.00) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL4122027 0.87 GLRA3 (0.69) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL9351487 0.87 GLRA3 (0.59) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL9351679 0.87 GLRA3 (0.59) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL9352392 0.87 GLRA3 (0.64) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL9351606 0.87 GLRA3 (0.64) GLRA3GLRBSMN1; SMN2CA2ALDH1A1
SCHEMBL9351650 0.85 GLRA3 (0.62) GLRA3GLRBSMN1; SMN2CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0370389-B1 Nuclear substituted salicylic acids and their salts SANKO KAIHATSU KAGAKU KENK (JP) 1994-09-14 EP claimed
EP-0425687-B1 CLATHRATE COMPOUND OF RING-SUBSTITUTED SALICYLIC ACID SALT SANKO KAIHATSU KAGAKU KENK (JP) 1994-07-06 EP claimed
US-5049685-A Nuclear substituted salicylic acids and their salts SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1991-09-17 US claimed
EP-0370389-A2 Nuclear substituted salicylic acids and their salts Sanko Kaihatsu Kagaku Kenkyusho (JP) 1990-05-30 EP claimed
JP-2142747-A None JP disclosed
EP-0885745-B1 Thermosensitive recording sheet set for preservation temperature control and method of using the sheet set OJI PAPER CO (JP) 2001-09-19 EP disclosed
US-5994262-A MULTILAYER; RECORDING SHEET CONTAINING ZINC SALT OF A SALICYLIC ACID; ADHESIVE LAYER CONTAINING A LEUCO DYE AND AN ESTER; TEMPERATURE CONTROL OJI PAPER CO., LTD. (JP) 1999-11-30 US disclosed
EP-0428994-B1 Method for preparing aqueous dispersion of developer and pressure-sensitive recording paper SANKO KAIHATSU KAGAKU KENK (JP) 1999-03-10 EP disclosed
EP-0885745-A1 Thermosensitive recording sheet set for preservation temperature control and method of using the sheet set Oji Paper Co., Ltd. (JP) 1998-12-23 EP disclosed
US-5647896-A MULTIVALENT SALT OF A SALICYLIC ACID DERIVATIVE, SULFONATED PHENOL MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
EP-0714785-A1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-06-05 EP disclosed
EP-0370389-B1 Nuclear substituted salicylic acids and their salts SANKO KAIHATSU KAGAKU KENK (JP) 1994-09-14 EP disclosed
US-5204190-A Nuclear-substituted salicyclic acid salt emulsified and disperions in aqueous solution of acyrlamide acrylamide copolymer SANKO KAIHATSU KAGAKU KENYUSHO (JP) 1993-04-20 US disclosed
US-5164001-A Salicylic salt, acrylamide copolymer SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-11-17 US disclosed
US-5107006-A Photostabilizers developers SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1992-04-21 US disclosed
US-5049685-A Nuclear substituted salicylic acids and their salts SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1991-09-17 US disclosed
EP-0428994-A1 Method for preparing aqueous dispersion of developer and pressure-sensitive recording paper Sanko Kaihatsu Kagaku Kenkyusho (JP) 1991-05-29 EP disclosed
EP-0425687-A1 CLATHRATE COMPOUND OF RING-SUBSTITUTED SALICYLIC ACID SALT Sanko Kaihatsu Kagaku Kenkyusho (JP) 1991-05-08 EP disclosed
JP-H02142747-A NUCLEUS-SUBSTITUTED SALICYLIC ACID AND SALT THEREOF SANKO KAIHATSU KAGAKU KENKYUSHO:KK 1990-05-31 JP disclosed
EP-0370389-A2 Nuclear substituted salicylic acids and their salts Sanko Kaihatsu Kagaku Kenkyusho (JP) 1990-05-30 EP disclosed