SCHEMBL7545898

SCHEMBL7545898

Cc1sccc1C(=O)c1ccnc(N)c1C(=O)Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.36
KDR P35968 7/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.31
BTK Q06187 1/20 0.31
NAPRT Q6XQN6 1/20 0.30
PLK4 O00444 1/20 0.30
AURKA O14965 1/20 0.30
ROCK2 O75116 1/20 0.30
RPS6KA5 O75582 1/20 0.30
RPS6KA4 O75676 1/20 0.30

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
SCHEMBL7556390 0.88 NAPRT (0.37) NAMPTKDRMEN1KMT2ARAB9A
SCHEMBL7549098 0.83 RAB9A (0.41) NAMPTKDRRAB9AMAPTNPC1
SCHEMBL7600813 0.80
SCHEMBL7548471 0.78 MAPK13 (0.41) ALDH1A1NAPRTNOS3NOS2
SCHEMBL7553256 0.77 RAB9A (0.40) NAMPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL9060466 0.76 NOS3 (0.40) KDRKMT2ARAB9AALDH1A1MAPT
SCHEMBL7549213 0.75 L3MBTL1 (0.41) KDRRAB9AALDH1A1MAPTLMNA
SCHEMBL7546196 0.74 KDM4E (0.38) RAB9ANPC1NOS3NOS2LIMK1
SCHEMBL7553486 0.74 ALDH1A1 (0.37) ALDH1A1MAPTLMNANAPRTNOS3
SCHEMBL7550244 0.74 MAPK14 (0.35) KDRKMT2ARAB9ALMNANPC1

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-1997049708-A9 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS 1998-05-22 WO disclosed