SCHEMBL8972723

SCHEMBL8972723

O=C(O)CCC(Sc1nc2ccccc2s1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.61
▸ HSD17B10 Q99714 4/20 0.61
▸ ALDH1A1 P00352 4/20 0.61
▸ HPGD P15428 4/20 0.61
▸ MAPK1 P28482 3/20 0.61
▸ TSHR P16473 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ PPARA Q07869 5/20 0.55
▸ LMNA P02545 2/20 0.52
▸ USP2 O75604 1/20 0.52
▸ APEX1 P27695 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ ALOX15 P16050 3/20 0.49
▸ HTT P42858 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ PPARG P37231 2/20 0.48
▸ PPARD Q03181 2/20 0.48
▸ CYP1A2 P05177 3/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ HIF1A Q16665 2/20 0.48

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
SCHEMBL9305131 0.92 POLB (0.59) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL9305220 0.91 POLB (0.57) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL9179542 0.90 POLB (0.56) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL402778 0.86 ALDH1A1 (0.57) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL717957 0.86 LMNA (0.63) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL10893548 0.85 ALDH1A1 (0.56) POLBHSD17B10ALDH1A1HPGDMAPK1
Ammonia Solution, Strong SCHEMBL7033477 0.85 ALDH1A1 (0.56) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL28421418 0.85 ALDH1A1 (0.56) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL10895810 0.85 ALDH1A1 (0.56) POLBHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL7034394 0.85 PPARA (0.62) HSD17B10MAPK1TSHRPPARALMNA

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723425-B2 Pigment compositions with modified ATRP copolymer dispersants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-05-25 — — US disclosed
US-7723425-B2 Pigment compositions with modified ATRP copolymer dispersants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-05-25 — — US disclosed
US-5549847-A STIRRING A FILTER CAKE OF CORROSION INHIBITOR WITH DISPERSANT AND THICKENER; STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1996-08-27 — — US disclosed
EP-0511163-B1 Pourable aqueous dispersions of polycarboxylic acid corrosion inhibitors CIBA GEIGY AG (CH) 1995-07-26 — — EP disclosed
US-5347008-A Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents CIBA-GEIGY CORPORATION (US) 1994-09-13 — — US disclosed
EP-0375614-B1 CORROSION-INHIBITING COATING COMPOSITIONS CIBA-GEIGY AG (CH) 1993-03-31 — — EP disclosed
US-5198482-A Benzothiazole carboxylic acid amine salt CIBA-GEIGY CORPORATION (US) 1993-03-30 — — US disclosed
EP-0511163-A1 Pourable aqueous dispersions of polycarboxylic acid corrosion inhibitors CIBA-GEIGY AG (CH) 1992-10-28 — — EP disclosed
US-5152929-A Corrosion inhibitors for water systems CIBA-GEIGY CORPORATION (US) 1992-10-06 — — US disclosed
EP-0129506-B1 HETEROCYCLICALLY SUBSTITUTED THIO(CYCLO)ALKANE POLYCARBOXYLIC ACIDS CIBA-GEIGY AG (CH) 1991-03-06 — — EP disclosed
EP-0375614-A1 Corrosion-inhibiting coating compositions CIBA-GEIGY AG (CH) 1990-06-27 — — EP disclosed
EP-0128862-B1 ANTI-CORROSIVE COATING COMPOSITION CIBA-GEIGY AG (CH) 1989-03-01 — — EP disclosed
EP-0183647-B1 ANTI-CORROSIVE AQUEOUS PAINTS CIBA-GEIGY AG (CH) 1989-02-15 — — EP disclosed
US-4612378-A Process for the preparation of β-(benzothiazolylthio)- and β-(benzimidazolylthio-carboxylic acids CIBA-GEIGY CORPORATION (US) 1986-09-16 — — US disclosed
US-4612049-A BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID CIBA-GEIGY CORPORATION (US) 1986-09-16 — — US disclosed
EP-0183647-A1 Anti-corrosive aqueous paints CIBA-GEIGY AG (CH) 1986-06-04 — — EP disclosed
EP-0129506-A2 Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids CIBA-GEIGY AG (CH) 1984-12-27 — — EP disclosed
EP-0128862-A2 Anti-corrosive coating composition CIBA-GEIGY AG (CH) 1984-12-19 — — EP disclosed
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