SCHEMBL8519904

SCHEMBL8519904

N#Cc1cc(-c2ccccc2S(N)(=O)=O)c(-c2ccc(F)cc2)nc1SCc1ccc2ccccc2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HBB P68871 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE10A Q9Y233 9/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
TRPV1 Q8NER1 1/20 0.36
HTR2B P41595 1/20 0.35
F10 P00742 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
ALOX5AP P20292 1/20 0.33

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
SCHEMBL8095741 0.89 PDE10A (0.43) TSHRTP53MAPTHPGDALOX15
SCHEMBL8092688 0.83 MAPK13 (0.43) TSHRTP53MAPTHPGDALOX15
SCHEMBL8519868 0.78 TRPV1 (0.42) ALDH1A1LMNATRPV1F10CA12
SCHEMBL8519903 0.78 MAPT (0.41) TSHRTP53MAPTHPGDALOX15
SCHEMBL8520426 0.77 ALDH1A1 (0.52) TSHRMAPTHPGDHBBSMN1; SMN2
SCHEMBL8094384 0.72 MAPK13 (0.47) ALDH1A1LMNACA12CA1CA2
SCHEMBL8086490 0.69 ALDH1A1 (0.42) ALDH1A1LMNACA12CA1CA2
SCHEMBL8086039 0.68 TSHR (0.50) TSHRMAPTHPGDALOX15SMN1; SMN2
SCHEMBL8095193 0.68 CNR1 (0.46) ALDH1A1LMNACA12CA1CA2
SCHEMBL8104361 0.67 ALDH1A1 (0.46) HPGDALDH1A1LMNACA12CA1

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-5916905-A ANTIARTHRITIC AGENTS; ANALGESICS; ANTIPYRETICS G. D. SEARLE & CO. (US) 1999-06-29 US disclosed