SCHEMBL8719307

SCHEMBL8719307

COc1ccccc1-c1nnc(Sc2nccs2)n1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
CNR2 P34972 1/20 0.46
TSHR P16473 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 2/20 0.44
LMNA P02545 1/20 0.44
PRNP P04156 1/20 0.44
PPARG P37231 1/20 0.44
GFER P55789 1/20 0.44
NCOA2 Q15596 1/20 0.44
NCOA1 Q15788 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
MAPK1 P28482 1/20 0.42

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
SCHEMBL8032745 0.81 MEN1 (0.45) KMT2ACYP3A4TSHRSMN1; SMN2ALDH1A1
SCHEMBL8709945 0.80 ALDH1A1 (0.52) TP53KMT2ACYP3A4CYP2C19CNR2
SCHEMBL8041924 0.79 TSHR (0.66) KMT2ACYP3A4CYP2C19TSHRSMN1; SMN2
SCHEMBL8047690 0.79 SMN1; SMN2 (0.50) TP53KMT2ATSHRSMN1; SMN2ALDH1A1
SCHEMBL8033699 0.78 KMT2A (0.55) TP53KMT2ACYP3A4CYP2C19CNR2
SCHEMBL8712945 0.78 TP53 (0.51) TP53KMT2ACYP3A4CYP2C19CNR2
SCHEMBL8710522 0.77 TP53 (0.46) TP53KMT2ACYP3A4CYP2C19CNR2
SCHEMBL8042081 0.76 TSHR (0.44) KMT2ACYP3A4CYP2C19TSHRSMN1; SMN2
SCHEMBL8046022 0.76 TP53 (0.45) TP53KMT2ACYP3A4CYP2C19CNR2
SCHEMBL8716316 0.76 TP53 (0.54) TP53KMT2ACYP3A4CYP2C19CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed