SCHEMBL11332843

SCHEMBL11332843

Cc1sc(NC(=O)C(C)C)c(C(N)=O)c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AIP O00170 1/20 0.60
SGTA O43765 1/20 0.60
TOMM70 O94826 1/20 0.60
STIP1 P31948 1/20 0.60
PPP5C P53041 1/20 0.60
FKBP4 Q02790 1/20 0.60
PPID Q08752 1/20 0.60
FKBP5 Q13451 1/20 0.60
FKBP8 Q14318 1/20 0.60
TOMM34 Q15785 1/20 0.60
DNAJC7 Q99615 1/20 0.60
AIPL1 Q9NZN9 1/20 0.60
STUB1 Q9UNE7 1/20 0.60
CYP1A2 P05177 2/20 0.59
CYP2C9 P11712 2/20 0.59
CYP2C19 P33261 2/20 0.59
POLB P06746 2/20 0.59
KMT2A Q03164 3/20 0.59
ALDH1A1 P00352 9/20 0.57
RAB9A P51151 6/20 0.57

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
SCHEMBL11324603 0.81 AIP (0.66) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8277600 0.78 AIP (0.62) AIPSGTATOMM70STIP1PPP5C
SCHEMBL4091316 0.74 ALDH1A1 (0.58) AIPSGTATOMM70STIP1PPP5C
SCHEMBL7669562 0.74 AIP (0.53) AIPSGTATOMM70STIP1PPP5C
SCHEMBL7003132 0.74 ALDH1A1 (0.64) AIPSGTATOMM70STIP1PPP5C
SCHEMBL7003934 0.73 ALDH1A1 (0.70) AIPSGTATOMM70STIP1PPP5C
SCHEMBL6997928 0.72 GRIN2C (0.67) CYP2C9CYP2C19KMT2AALDH1A1RAB9A
SCHEMBL7902809 0.72 GRIN2C (1.00) AIPSGTATOMM70STIP1PPP5C
SCHEMBL7003164 0.71 FLT3 (0.70) AIPSGTATOMM70STIP1PPP5C
SCHEMBL8288778 0.71 FLT3 (0.73) CYP1A2CYP2C9CYP2C19POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0004931-B1 USE OF DERIVATIVES OF FURAN AND THIOPHENE AS PLANT-GROWTH REGULATING AGENTS BAYER AG (DE) 1981-08-05 EP disclosed
US-4240820-A Method of regulating the growth of plants BAYER AKTIENGESELLSCHAFT (DE) 1980-12-23 US disclosed