SCHEMBL8136351

SCHEMBL8136351

CC1=CC2(Oc3c1ccc1ccccc31)C1CCCC2CCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.42
HTR2A P28223 2/20 0.42
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP19A1 P11511 3/20 0.35
CYP1A2 P05177 2/20 0.33
CYP2A6 P11509 1/20 0.33
SLC6A2 P23975 4/20 0.33
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL8126965 0.80 HTR2C (0.44) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL4625971 0.72 HTR2C (0.36) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL2400816 0.64 KDM4E (0.49) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL31217582 0.61 ALDH1A1 (0.47) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL13250621 0.61 ESR1 (0.46) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL10298951 0.61 ALDH1A1 (0.60) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL16284358 0.60 ALDH1A1 (0.46) KDM4EALDH1A1TSHRHPGDHTT
SCHEMBL13250629 0.59 DNMT1 (0.41) HTR2CHTR2AKDM4EALDH1A1TSHR
SCHEMBL14144031 0.57 ALDH1A1 (0.50) KDM4EALDH1A1HPGDHTTMEN1
SCHEMBL12865358 0.57 DNMT1 (0.46) HTR2CHTR2AKDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696582-B1 Polycyclic spirophthalimide derivatives, process for their preparation and their use as fulgimides TOKUYAMA CORP (JP) 2000-03-22 EP disclosed
US-5631382-A PHOTOCHROMIC LENSES TOKUYAMA CORPORATION (JP) 1997-05-20 US disclosed
EP-0696582-A1 Polycyclic spirophthalimide derivatives, process for their preparation and their use as fulgimides TOKUYAMA CORPORATION (JP) 1996-02-14 EP disclosed