SCHEMBL27474385

SCHEMBL27474385

CCNc1ccc2c3c(cccc13)CC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.57
KDM4E B2RXH2 5/20 0.57
HSD17B10 Q99714 1/20 0.57
ALDH1A1 P00352 12/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
GAA P10253 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
POLB P06746 2/20 0.56
ATM Q13315 1/20 0.56
LMNA P02545 4/20 0.53
CYP1A2 P05177 3/20 0.48
CYP2C19 P33261 3/20 0.48
IDO1 P14902 1/20 0.47
MAPT P10636 6/20 0.47
HTT P42858 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SCN2A Q99250 1/20 0.47

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
SCHEMBL8714067 0.79 KDM4E (0.67) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL16224674 0.76 FGFR1 (0.37) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL4983073 0.76 KDM4E (0.47) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL6628730 0.76 ALDH1A1 (0.61) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL31270892 0.76 ALDH1A1 (0.61) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL27972665 0.75 CYP11B1 (0.41) HPGDKDM4EHSD17B10ALDH1A1MEN1
Hydrochloric Acid SCHEMBL29913261 0.74 ALDH1A1 (0.59) HPGDKDM4EHSD17B10ALDH1A1MEN1
Hydrochloric Acid SCHEMBL27157845 0.74 ALDH1A1 (0.59) HPGDKDM4EHSD17B10ALDH1A1MEN1
SCHEMBL20099158 0.74 IDO1 (0.50) KDM4EALDH1A1MEN1KMT2APOLB
SCHEMBL29093412 0.73 KDM4E (0.48) HPGDKDM4EHSD17B10ALDH1A1MEN1

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
CN-1173931-C Acenaphthene derivative compound and its application 宋 航 2004-11-03 CN disclosed
CN-1394849-A Acenaphthene derivative compound and its application SONG HANG (CN) 2003-02-05 CN disclosed