SCHEMBL9307865

SCHEMBL9307865

Cc1cc(Cl)cc2sc(C(CC(=O)O)C(O)=S)nc12

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PRKCZ Q05513 1/20 0.39
F2RL3 Q96RI0 1/20 0.35
CTSA P10619 13/20 0.35
GAA P10253 1/20 0.34

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
SCHEMBL9307854 0.90 NPC1 (0.36) NPC1RAB9APRKCZF2RL3
SCHEMBL9307851 0.81 NPC1 (0.40) NPC1RAB9APRKCZF2RL3GAA
SCHEMBL8972435 0.78 AKR1B1 (0.44) NPC1RAB9AGAA
SCHEMBL9304179 0.77 GAA (0.41) NPC1RAB9ACTSAGAA
SCHEMBL9305741 0.76 STING1 (0.30)
SCHEMBL8973369 0.75 HDAC6 (0.55)
SCHEMBL10891400 0.73 PRKCZ (0.39) PRKCZCTSA
SCHEMBL8972535 0.72 DYRK1A (0.45) NPC1RAB9ACTSAGAA
SCHEMBL9307207 0.72 CTSA (0.32) CTSA
SCHEMBL9307859 0.72 PPARA (0.48) NPC1RAB9APRKCZF2RL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-5152929-A Corrosion inhibitors for water systems CIBA-GEIGY CORPORATION (US) 1992-10-06 US disclosed
EP-0375614-A1 Corrosion-inhibiting coating compositions CIBA-GEIGY AG (CH) 1990-06-27 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