SCHEMBL15967962

SCHEMBL15967962

CC1=CCc2cccc3cccc1c23

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.46
HPGD P15428 7/20 0.46
KDM4E B2RXH2 4/20 0.46
HSD17B10 Q99714 8/20 0.43
TYMS P04818 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.42
PARP1 P09874 2/20 0.42
TSHR P16473 5/20 0.40
CYP3A4 P08684 3/20 0.40
MAPK1 P28482 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 1/20 0.38
CES2 O00748 1/20 0.35
BCHE P06276 1/20 0.35
CES1 P23141 1/20 0.35
MCL1 Q07820 1/20 0.35
TP53 P04637 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL11216815 0.87 ALDH1A1 (0.37) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL7161085 0.82 ALDH1A1 (0.33) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL28060444 0.79 TSHR (0.41) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL5538790 0.78 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL27807088 0.78 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL23234268 0.77 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL308273 0.76 HTR6 (0.40) ALDH1A1HPGDKDM4EBCHECES1
SCHEMBL10532536 0.76 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL28352725 0.76 HSD17B10 (0.50) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL9625185 0.76 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EHSD17B10TYMS

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-107849199-A Resin and surface protection board or materials used in auto manufacturing 住友化学株式会社 2018-03-27 CN disclosed
CN-107001286-A The assimilation compound of dihydro-pyrimidin 2 and its medical usage 日本烟草产业株式会社 2017-08-01 CN disclosed
US-9206276-B2 Photosensitive copolymer, photoresist comprising the copolymer, and method of forming an electronic device ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2015-12-08 US disclosed
US-20140242521-A1 PHOTOSENSITIVE COPOLYMER, PHOTORESIST COMPRISING THE COPOLYMER, AND METHOD OF FORMING AN ELECTRONIC DEVICE U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2014-08-28 US disclosed