SCHEMBL9260925

SCHEMBL9260925

Fc1ccccc1C1(c2cc3ccccc3o2)C=Cc2c(ccc3ccccc23)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
AHR P35869 2/20 0.31
CYP1A1 P04798 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP1B1 Q16678 2/20 0.31
PRKDC P78527 1/20 0.31
CHRM2 P08172 1/20 0.31

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
SCHEMBL9257841 0.84 KDM4E (0.41) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL4581554 0.83 KDM4E (0.40) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL3160917 0.79 KDM4E (0.39) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL5097862 0.77 KDM4E (0.40) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL3166406 0.76 KDM4E (0.39) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL7821439 0.76 NPC1 (0.37) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL3162160 0.76 KDM4E (0.38) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL2599683 0.75 ALDH1A1 (0.38) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL2599681 0.75 KDM4E (0.38) KDM4EALDH1A1HPGDMEN1NPC1
SCHEMBL2400659 0.75 KDM4E (0.38) KDM4EALDH1A1HPGDMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5429774-A FOR USE IN PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 1995-07-04 US claimed
US-5429774-A FOR USE IN PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 1995-07-04 US disclosed