SCHEMBL28465873

SCHEMBL28465873

OB(O)c1ccc2c(c1)Cc1ccccc1-2.c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.47
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
LMNA P02545 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MAPT P10636 2/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP1A2 P05177 5/20 0.42
CYP3A4 P08684 4/20 0.42
HSD17B10 Q99714 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2D6 P10635 1/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
ADRA2A P08913 1/20 0.40
MAOA P21397 1/20 0.40
SLC6A2 P23975 1/20 0.40

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
SCHEMBL257860 0.90 NPC1 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL30088382 0.90 NPC1 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL5497676 0.84 MAPT (0.47) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL3794329 0.83 NPC1 (0.48) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL13720834 0.82 CYP1A2 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL13720759 0.82 CYP1A2 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL13720534 0.82 CYP1A2 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL14069627 0.82 CYP1A2 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
SCHEMBL13018372 0.82 CYP1A2 (0.53) SRD5A2ALDH1A1KDM4ELMNANPC1
Fluorene SCHEMBL3191531 0.81 MAOA (0.50) SRD5A2ALDH1A1KDM4ELMNANPC1

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
CN-111825722-A Saturated red luminescent fluorenyl benzoquinoline iridium complex 北京印刷学院 2020-10-27 CN disclosed