SCHEMBL7789620

SCHEMBL7789620

COc1cc2cc(O)c3c(c2cc1OC)-c1ccccc1C3

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PDE10A Q9Y233 1/20 0.41
MIF P14174 2/20 0.40
CES2 O00748 1/20 0.40
CHEK1 O14757 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
HIF1A Q16665 1/20 0.38
CRHBP P24387 1/20 0.38

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
SCHEMBL13880266 0.88 DRD2 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL7789933 0.83 ALDH1A1 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13766161 0.80 DRD2 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13880445 0.80 DRD2 (0.43) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL7784188 0.78 TRPM4 (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL21877452 0.75 ALDH1A1 (0.46) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL29011630 0.73 KDM4E (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10049850 0.72 MIF (0.39) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL10102360 0.71 ALOX5 (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL21877223 0.71 MAPT (0.46) MEN1KMT2AKDM4EALDH1A1MAPT

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-1042312-B1 PHOTOCHROMIC INDENO-FUSED NAPHTHO[2,1-b]PYRANS TRANSITIONS OPTICAL INC (US) 2001-11-07 EP claimed
EP-1042312-B1 PHOTOCHROMIC INDENO-FUSED NAPHTHO[2,1-b]PYRANS TRANSITIONS OPTICAL INC (US) 2001-11-07 EP disclosed
US-5869658-A POLYMERIC ORGANIC HOST MATERIALS THAT CONTAIN OR THAT ARE COATED WITH THE NOVEL NAPHTHOPYRAN COMPOUNDS, LENSES PPG INDUSTRIES, INC. (US) 1999-02-09 US disclosed