SCHEMBL8569422

SCHEMBL8569422

Cc1c(-c2ccccc2-c2ccccc2)csc1C(=O)N(C)C

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
RXFP1 Q9HBX9 1/20 0.43
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
BCAT2 O15382 1/20 0.40
HTR2C P28335 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.38
PRKCZ Q05513 1/20 0.38
RECQL P46063 1/20 0.37
GPR35 Q9HC97 1/20 0.36
RAB9A P51151 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
MAPK1 P28482 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
SCHEMBL6277246 0.76 GPR35 (0.49) SMN1; SMN2MEN1KMT2AHPGDNPC1
SCHEMBL8569426 0.74 TACR1 (0.42) SMN1; SMN2MEN1KMT2ARXFP1HPGD
SCHEMBL7445918 0.73 MEN1 (0.86) SMN1; SMN2MEN1KMT2AHPGDNPC1
Hydrogen Sulfide SCHEMBL28029146 0.71 MEN1 (0.83) SMN1; SMN2MEN1KMT2AHPGDNPC1
SCHEMBL3760398 0.70 MEN1 (0.74) SMN1; SMN2MEN1KMT2ARXFP1HPGD
SCHEMBL12261074 0.69 ESR1 (0.38) SMN1; SMN2MEN1KMT2ARXFP1HPGD
SCHEMBL12261073 0.69 GPR35 (0.42) SMN1; SMN2NPC1HTR2CALDH1A1TP53
SCHEMBL30463435 0.69 MEN1 (1.00) SMN1; SMN2MEN1KMT2ABCAT2ALDH1A1
SCHEMBL6677412 0.69 MEN1 (1.00) SMN1; SMN2MEN1KMT2ABCAT2ALDH1A1
SCHEMBL8574893 0.68 MEN1 (0.51) SMN1; SMN2MEN1KMT2ARXFP1HPGD

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