SCHEMBL7536764

SCHEMBL7536764

O=c1[nH]cc(-c2ccccn2)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.51
KDM4E B2RXH2 8/20 0.47
LMNA P02545 6/20 0.47
NPC1 O15118 6/20 0.47
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
HIF1A Q16665 2/20 0.46
CCR1 P32246 2/20 0.46
CCR5 P51681 2/20 0.46
CCR8 P51685 2/20 0.46
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
METAP1 P53582 1/20 0.46
BLM P54132 1/20 0.46
DOHH Q9BU89 1/20 0.46
P4HTM Q9NXG6 1/20 0.46
CCNB2 O95067 1/20 0.45
CDK1 P06493 1/20 0.45

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
SCHEMBL8675092 0.79 ALDH1A1 (0.56) BTKKDM4ELMNANPC1RAB9A
SCHEMBL27196408 0.76 KDM4E (0.54) BTKKDM4ELMNANPC1RAB9A
SCHEMBL15271337 0.75 BTK (0.35) BTKKDM4ELMNANPC1RAB9A
SCHEMBL29624537 0.73 KDM4E (0.62) BTKKDM4ELMNANPC1RAB9A
SCHEMBL1456454 0.73 KDM4E (0.62) BTKKDM4ELMNANPC1RAB9A
SCHEMBL20510086 0.73 KDM4E (0.50) BTKKDM4ELMNANPC1RAB9A
SCHEMBL1988750 0.73 KDM4E (0.58) BTKKDM4ELMNANPC1RAB9A
SCHEMBL5709792 0.72 NOTUM (0.52) BTKKDM4ELMNANPC1RAB9A
SCHEMBL29664837 0.72 NOTUM (0.52) BTKKDM4ELMNANPC1RAB9A
SCHEMBL1456955 0.71 KDM4E (0.59) BTKKDM4ELMNANPC1RAB9A

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-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 US disclosed