SCHEMBL17944682

SCHEMBL17944682

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc5sc6c(ccc7c8ccccc8sc76)c5c4)c4ccccc34)ccc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
PARP14 Q460N5 1/20 0.33
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PRKDC P78527 3/20 0.32
GPR3 P46089 1/20 0.30
PTPN1 P18031 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
SCHEMBL19110293 0.98 ALOX5 (0.40) ALOX5PARP14MAPTALDH1A1HPGD
SCHEMBL21687080 0.93 GPR3 (0.37) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL23502128 0.91 ALOX5 (0.33) ALOX5
SCHEMBL17944393 0.91 ALOX5 (0.42) ALOX5PARP14MAPTALDH1A1HPGD
SCHEMBL19082395 0.90 CYP1A1 (0.32) ALOX5
SCHEMBL19110292 0.90 ALOX5 (0.34) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17945738 0.89 ALDH1A1 (0.36) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL17944982 0.89 GPR3 (0.34) ALOX5MAPTALDH1A1HPGDRAB9A
SCHEMBL19077524 0.89 ALOX5 (0.37) ALOX5PARP14MAPTALDH1A1HPGD
SCHEMBL13487721 0.88 ALDH1A1 (0.34) ALOX5MAPTALDH1A1HPGDRAB9A

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-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed