SCHEMBL13061699

SCHEMBL13061699

Cc1ccc(Nc2cccc(N(c3ccc(C)cc3)c3ccc(-c4ccccc4)cc3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.53
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
MAPT P10636 5/20 0.43
ALDH1A1 P00352 3/20 0.43
AR P10275 1/20 0.43
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
LMNA P02545 3/20 0.40
TP53 P04637 2/20 0.40
POLB P06746 1/20 0.40
GBA1 P04062 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TDP1 Q9NUW8 2/20 0.38

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
SCHEMBL22815430 0.93 HPGD (0.50) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL8765427 0.92 HPGD (0.57) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL14549384 0.91 NPSR1 (0.62) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL13175273 0.91 HPGD (0.52) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL12955837 0.91 HPGD (0.56) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL12955703 0.91 HPGD (0.52) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL12955701 0.91 HPGD (0.59) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL19738487 0.91 ALDH1A1 (0.52) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL19738392 0.91 ALDH1A1 (0.52) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL16890402 0.91 ALDH1A1 (0.52) HPGDNPSR1MEN1KMT2AMAPT

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-7855286-B2 Titanyl phthalocyanin crystal, method for preparing the same and electrophotographic photoconductor KYOCERA MITA CORPORATION (JP) 2010-12-21 US disclosed