SCHEMBL27477884

SCHEMBL27477884

COc1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.96
NPC1 O15118 10/20 0.96
KDM4E B2RXH2 7/20 0.72
USP2 O75604 1/20 0.72
KMT2A Q03164 2/20 0.71
HPGD P15428 7/20 0.69
ALDH1A1 P00352 6/20 0.69
SMN1; SMN2 Q16637 5/20 0.69
MAPT P10636 4/20 0.69
HSD17B10 Q99714 3/20 0.69
TP53 P04637 2/20 0.69
NFKB1 P19838 2/20 0.69
NFKB2 Q00653 2/20 0.69
RELA Q04206 2/20 0.69
CYP2C19 P33261 2/20 0.69
CYP1A2 P05177 1/20 0.69
CYP3A4 P08684 1/20 0.69
POLB P06746 2/20 0.61
ENPP3 O14638 1/20 0.59
ENPP1 P22413 1/20 0.59

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
SCHEMBL29121418 0.98 RAB9A (1.00) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL17614677 0.93 RAB9A (0.90) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL13004548 0.90 NPC1 (0.85) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL14466538 0.87 RAB9A (0.73) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL17877090 0.85 NPC1 (0.96) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL16675218 0.85 NPC1 (0.76) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL74517 0.85 NPC1 (0.70) RAB9ANPC1KDM4EUSP2KMT2A
SCHEMBL46424 0.84 NPC1 (0.90) RAB9ANPC1KDM4EKMT2AHPGD
SCHEMBL22858502 0.84 NPC1 (0.90) RAB9ANPC1KDM4EKMT2AHPGD
SCHEMBL74999 0.84 NPC1 (0.90) RAB9ANPC1KDM4EKMT2AHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1173004-C Method for preparing organic phosporescence material 中国科学院长春应用化学研究所 2004-10-27 CN claimed
CN-1405267-A Method for preparing organic phosporescence material CHANGCHUN APPLIED CHEMISTRY (CN) 2003-03-26 CN claimed
CN-1173004-C Method for preparing organic phosporescence material 中国科学院长春应用化学研究所 2004-10-27 CN disclosed
CN-1405267-A Method for preparing organic phosporescence material CHANGCHUN APPLIED CHEMISTRY (CN) 2003-03-26 CN disclosed