SCHEMBL8569426

SCHEMBL8569426

Cc1csc(C(=O)N(C)c2ccccc2-c2ccccc2)c1C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B1 P14061 4/20 0.40
HSD17B2 P37059 3/20 0.40
BCAT2 O15382 1/20 0.38
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
TP53 P04637 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.36
ESR1 P03372 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL8569422 0.74 SMN1; SMN2 (0.51) MEN1KMT2ASMN1; SMN2BCAT2ALDH1A1
SCHEMBL5883327 0.73 TACR1 (0.54) TACR1MEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL7452209 0.73 TACR1 (0.46) TACR1MEN1KMT2ASMN1; SMN2HSD17B1
SCHEMBL8574900 0.72 TACR1 (0.42) TACR1MEN1KMT2ASMN1; SMN2HSD17B1
Hydrochloric Acid SCHEMBL5883686 0.72 TACR1 (0.52) TACR1MEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL8570029 0.71 KDM4E (0.40) TACR1MEN1KMT2ASMN1; SMN2HSD17B1
SCHEMBL31393815 0.71 TACR1 (0.51) TACR1MEN1KMT2ASMN1; SMN2BCAT2
SCHEMBL8574194 0.70 TACR1 (0.43) TACR1MEN1KMT2ASMN1; SMN2HSD17B1
SCHEMBL8569641 0.70 MEN1 (0.47) TACR1MEN1KMT2ASMN1; SMN2HSD17B1
SCHEMBL7409011 0.70 KMT2A (0.45) TACR1MEN1KMT2ASMN1; SMN2ALDH1A1

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
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US disclosed