SCHEMBL9633633

SCHEMBL9633633

[N-]=[N+]=C1C=C(OP(=O)(O)O)C(Nc2ccccc2)=CC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.34
IDO1 P14902 1/20 0.30
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
PDE3A Q14432 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9632853 0.88 CA12 (0.32) KDM4EALDH1A1HPGD
SCHEMBL9634193 0.85 SRC (0.36) SRC
SCHEMBL9632817 0.84 KMT2A (0.38) KDM4EALDH1A1
SCHEMBL9634644 0.81
SCHEMBL9632663 0.81 NPC1 (0.31) ALDH1A1
SCHEMBL9634766 0.78
SCHEMBL9633603 0.76 S1PR4 (0.30)
SCHEMBL9633301 0.75 SRC (0.37) SRCKDM4EUSP2ALDH1A1HPGD
SCHEMBL8925475 0.75 MAP2K7 (0.34) ALDH1A1HPGD
SCHEMBL9633545 0.74 S1PR2 (0.36)

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
EP-0487343-A1 Process for preparing a lithographic plate Fuji Photo Film Co., Ltd. (JP) 1992-05-27 EP disclosed