SCHEMBL9305967

SCHEMBL9305967

CCCCCCc1ccc2nc(S)[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 6/20 0.60
S1PR1 P21453 6/20 0.60
S1PR5 Q9H228 5/20 0.60
TUBB4A P04350 6/20 0.51
TUBB P07437 6/20 0.51
TUBA3C P0DPH7 6/20 0.51
TUBA1B P68363 6/20 0.51
TUBA4A P68366 6/20 0.51
TUBB4B P68371 6/20 0.51
TUBB3 Q13509 6/20 0.51
TUBB2A Q13885 6/20 0.51
TUBB8 Q3ZCM7 6/20 0.51
TUBA3E Q6PEY2 6/20 0.51
TUBA1A Q71U36 6/20 0.51
TUBA1C Q9BQE3 6/20 0.51
TUBB6 Q9BUF5 6/20 0.51
TUBB2B Q9BVA1 6/20 0.51
TUBB1 Q9H4B7 6/20 0.51
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL8083831 0.94 TUBB4A (0.55) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL9305960 0.88 S1PR4 (0.47) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL10707113 0.88 TUBB4A (0.45) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL14557086 0.87 S1PR4 (0.45) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL28878987 0.84 S1PR4 (0.61) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL11416427 0.84 S1PR4 (0.61) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL9305648 0.82 S1PR4 (0.60) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL8083834 0.82 TUBB4A (0.43) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL9305459 0.81 ALDH1A1 (0.44) S1PR4S1PR1S1PR5TUBB4ATUBB
SCHEMBL26553941 0.78 RAD52 (0.58) S1PR4S1PR1S1PR5TLR8

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-0161220-B1 PROCESS FOR THE PREPARATION OF BETA-(BENZOTHIAZOLYLTHIO) AND BETA (BENZIMIDAZOLYLTHIO)CARBOXYLIC-ACID DERIVATIVES CIBA-GEIGY AG (CH) 1991-08-14 EP disclosed
US-4652653-A Process for the preparation of β-(benzothiazolylthio)- and β-(benzimidazolylthio)-carboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1987-03-24 US 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
EP-0161220-A2 Process for the preparation of beta-(benzothiazolylthio) and beta (benzimidazolylthio)carboxylic-acid derivatives CIBA-GEIGY AG (CH) 1985-11-13 EP disclosed
EP-0129506-A2 Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed
EP-0126030-A2 Process for the preparation of beta-(benzothiazolylthio) and beta-(benzimidazolylthio) carboxylic acids CIBA-GEIGY AG (CH) 1984-11-21 EP disclosed