SCHEMBL16622258

SCHEMBL16622258

Cc1ccccc1-c1ncc(-c2ccccc2-c2ccccc2)nc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 2/20 0.44
ENPP3 O14638 1/20 0.42
ENPP1 P22413 1/20 0.42
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDR P35968 2/20 0.41
PDGFRB P09619 1/20 0.41
FLT3 P36888 1/20 0.41
DPP4 P27487 1/20 0.40
ADORA2A P29274 2/20 0.39
PRKDC P78527 1/20 0.39
BTK Q06187 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA1 P30542 1/20 0.38
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36

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
SCHEMBL15256055 0.90 RAB9A (0.50) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL16622257 0.88 ATR (0.47) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL16622240 0.88 RAB9A (0.47) ENPP3ENPP1RAB9ANPC1SMN1; SMN2
SCHEMBL16622253 0.84 NPC1 (0.44) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL15256076 0.81 NPC1 (0.41) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL15256054 0.81 ALDH1A1 (0.45) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL15256060 0.80 ALDH1A1 (0.47) ATRENPP3ENPP1ADORA2AALDH1A1
SCHEMBL13072034 0.79 ALOX5AP (0.42) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16622238 0.79 NR3C1 (0.43) ATRENPP3ENPP1RAB9ANPC1
SCHEMBL16750238 0.79 CKS1B (0.49) ATRENPP3ENPP1RAB9ANPC1

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-20150214484-A1 Organometallic Complex and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Organometallic Complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-07-30 US disclosed
US-8999520-B2 Organometallic complex and light emitting element, light emitting device, and electronic device using the organometallic complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-04-07 US disclosed