SCHEMBL25530728

SCHEMBL25530728

Cc1cccc(N(C2=CC(C)CC=C2)c2ccc(N(c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
ALDH1A1 P00352 3/20 0.30
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
JAK2 O60674 1/20 0.30
HTT P42858 1/20 0.30
PAX8 Q06710 1/20 0.30
THRB P10828 1/20 0.30
PKM P14618 1/20 0.30
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
GAA P10253 1/20 0.30
HTR7 P34969 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
SCHEMBL12138153 1.00 HPGD (0.34) HPGDALDH1A1RAB9ANPC1JAK2
SCHEMBL12776035 0.96 HPGD (0.32) HPGD
SCHEMBL13808808 0.96 HPGD (0.32) HPGD
SCHEMBL19051665 0.93 HPGD (0.31) HPGD
SCHEMBL10066022 0.92 NPC1 (0.39) HPGDALDH1A1RAB9ANPC1MAPT
SCHEMBL12700630 0.91 HPGD (0.32) HPGDMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL21149622 0.89 RAB9A (0.36) ALDH1A1RAB9ANPC1JAK2HTT
SCHEMBL18828697 0.89 HPGD (0.30) HPGD
SCHEMBL19060605 0.89 HPGD (0.30) HPGD
SCHEMBL19774481 0.88 CYP2C19 (0.33) HPGDALDH1A1MAPTKDM4ECYP1A2

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
EP-3246963-B1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2023-05-31 EP disclosed