SCHEMBL14483863

SCHEMBL14483863

O=P(O)(O)c1ccc(C[n+]2ccc(C=Cc3cc[n+](Cc4ccc(O)cc4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 2/20 0.42
▸ KDM2A Q9Y2K7 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ CHKA P35790 3/20 0.35
▸ AKR1B10 O60218 1/20 0.33
▸ AKR1B1 P15121 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ GLO1 Q04760 1/20 0.33
▸ CAMK2A Q9UQM7 1/20 0.33
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA4 P22748 2/20 0.33
▸ CA6 P23280 2/20 0.33
▸ CA5A P35218 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
SCHEMBL14000553 0.94 KDM4A (0.46) KDM4AKDM2AALDH1A1GAAMAPT
SCHEMBL13974636 0.88 KDM4A (0.40) KDM4AKDM2AALDH1A1GAAMAPT
SCHEMBL14509019 0.82 KDM4A (0.36) KDM4AKDM2ACHKA
SCHEMBL915277 0.71 CA2 (0.57) ALDH1A1MAPTGFERCA12CA1
SCHEMBL2997700 0.69 CA2 (0.55) ALDH1A1MAPTGFERCA12CA1
SCHEMBL14077508 0.68 KDM4A (0.51) KDM4AKDM2AALDH1A1CHKABCHE
SCHEMBL24663298 0.67 CHKA (0.68) ALDH1A1GAAMAPTCHKABCHE
SCHEMBL14000552 0.67 CHAT (0.35) KDM4AKDM2AALDH1A1MAPTACHE
SCHEMBL14000554 0.66 CA2 (0.40) KDM4AKDM2AALDH1A1GAAMAPT
SCHEMBL28886060 0.65 ESR1 (0.55) ALDH1A1MAPTCA12CA1CA4

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-7236288-B2 Functional device, electrochromic device, optical device, and image-taking unit FUJIFILM CORPORATION (JP) 2007-06-26 — — US disclosed
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