SCHEMBL13680951

SCHEMBL13680951

CNC(=O)c1ccc(-c2nc(CCC=O)cs2)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.55
RAB9A P51151 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 2/20 0.55
TP53 P04637 5/20 0.51
LMNA P02545 4/20 0.49
POLB P06746 2/20 0.47
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL13681040 0.86 MAPT (0.43) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL13680932 0.86 KMT2A (0.47) MAPTRAB9ASMN1; SMN2TP53LMNA
SCHEMBL13680958 0.85 RXFP1 (0.57) MAPTRAB9ASMN1; SMN2TP53LMNA
SCHEMBL13680937 0.84 KDM4E (0.52) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL13680945 0.83 MEN1 (0.52) MAPTRAB9ATP53LMNAALDH1A1
SCHEMBL13680936 0.83 TP53 (0.46) MAPTTP53LMNAPOLB
SCHEMBL13680946 0.82 AVPR1B (0.47) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL13681039 0.82 MAPT (0.43) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL13680939 0.82 MAPT (0.47) MAPTRAB9ASMN1; SMN2TP53LMNA
SCHEMBL13681269 0.80 MAPT (0.47) MAPTRAB9ANPC1TP53LMNA

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-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed