SCHEMBL17899333

SCHEMBL17899333

c1ccc(-c2ccc3ccc4ccc(-c5ccc6ccc7ccc(-c8ccccc8)nc7c6n5)nc4c3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
RAB9A P51151 3/20 0.56
PARP1 P09874 2/20 0.55
ASIC3 Q9UHC3 1/20 0.46
ADORA2A P29274 2/20 0.43
AURKA O14965 1/20 0.43
HSP90AA1 P07900 1/20 0.43
PRKACA P17612 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ADORA1 P30542 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 2/20 0.42
AR P10275 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL29441293 0.97 MEN1 (0.59) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL1753930 0.97 MEN1 (0.59) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL30870477 0.95 MEN1 (0.56) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL30870479 0.95 MEN1 (0.56) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL10032304 0.95 MEN1 (0.56) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL19009617 0.93 MEN1 (0.70) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL25793453 0.93 MEN1 (0.70) MEN1KMT2ARAB9APARP1ASIC3
Hydrochloric Acid SCHEMBL4387023 0.93 RAB9A (0.54) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL30595380 0.93 MEN1 (0.54) MEN1KMT2ARAB9APARP1ASIC3
SCHEMBL20250404 0.93 MEN1 (0.54) MEN1KMT2ARAB9APARP1ASIC3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed