SCHEMBL9104399

SCHEMBL9104399

C1=CC(c2ccccc2)(c2ccc3oc4ccccc4c3c2)Oc2ccc3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.40
ALDH1A1 P00352 7/20 0.40
HPGD P15428 5/20 0.40
MAPT P10636 5/20 0.40
GLA P06280 3/20 0.40
NPC1 O15118 3/20 0.40
GAA P10253 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HNF4A P41235 1/20 0.35
RAB9A P51151 2/20 0.35
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 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
SCHEMBL9056690 0.85 KDM4E (0.44) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL30284405 0.85 KDM4E (0.50) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL361847 0.85 KDM4E (0.50) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL2517095 0.81 KDM4E (0.45) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL9257841 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL1387642 0.80 ALDH1A1 (0.40) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL1387871 0.77 NPC1 (0.38) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL5615529 0.77 ALDH1A1 (0.42) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL5615321 0.77 SMN1; SMN2 (0.43) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL5094572 0.77 KDM4E (0.40) KDM4EALDH1A1HPGDMAPTGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5552091-A PHOTOCHROMIC, LENSES PPG INDUSTRIES, INC. (US) 1996-09-03 US disclosed