SCHEMBL797469

SCHEMBL797469

CCCc1c2ccccc2c(CCC)c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
ALDH1A1 P00352 5/20 0.67
HPGD P15428 3/20 0.67
GAA P10253 1/20 0.67
RAB9A P51151 1/20 0.47
CYP1A2 P05177 2/20 0.42
HTT P42858 2/20 0.42
CYP2D6 P10635 1/20 0.42
SLC2A1 P11166 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
NCEH1 Q6PIU2 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
SCHEMBL10695260 0.92 KDM4E (0.58) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL7915227 0.92 KDM4E (0.58) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL3730672 0.89 KDM4E (0.56) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL22202247 0.88 ALDH1A1 (0.55) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL796895 0.88 KDM4E (0.55) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL27185541 0.86 ALDH1A1 (0.53) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL5678561 0.85 KDM4E (0.53) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL796530 0.84 KDM4E (0.52) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL29611102 0.83 KDM4E (0.50) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL4887109 0.83 KDM4E (0.50) KDM4EALDH1A1HPGDGAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105431778-A Photosensitive resin composition HITACHI CHEMICAL CO LTD 2016-03-23 CN disclosed
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed
US-6361885-B1 ANODES AND CATHODES FOR ELECTROLUMINESCENT DEVICE ORGANIC DISPLAY TECHNOLOGY 2002-03-26 US disclosed
US-6344284-B1 ORGANO-SILOXANE (CARBOSILANE) POLYMER HAVING A MAIN CHAIN COMPRISING ANTHRACENE AND/OR PENTACENE OPTIONALLY DOPED WITH A PORPHYRIN, AN AROMATIC TERTIARY AMINE OR A DYE ORGANIC DISPLAY TECHNOLOGY 2002-02-05 US disclosed
JP-2000299188-A ORGANIC VOLTAGE LUMINESCENT MATERIAL AND DEVICE MANUFACTURED FROM SUCH MATERIAL ORGANIC DISPLAY TECHNOLOGY 2000-10-24 JP disclosed
WO-2000031208-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES ORGANIC DISPLAY TECHNOLOGY (US) 2000-06-02 WO disclosed