SCHEMBL14835847

SCHEMBL14835847

CCCCCCCCCCCCCCCCN(C(Cc1ccc(O)c(O)c1)C(=O)O)[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM6B O15054 1/20 0.43
▸ SERPINE1 P05121 1/20 0.43
▸ HSD17B10 Q99714 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ SLC7A5 Q01650 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ TRPV1 Q8NER1 3/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL14836118 0.94 MAPT (0.46) KDM6BSERPINE1HSD17B10KDM4EUSP2
SCHEMBL29652213 0.83 KDM6B (0.49) KDM6BSERPINE1HSD17B10KDM4EUSP2
SCHEMBL20522200 0.79 KDM6B (0.47) KDM6BSERPINE1HSD17B10KDM4EUSP2
SCHEMBL20522201 0.79 KDM6B (0.47) KDM6BSERPINE1HSD17B10KDM4EUSP2
SCHEMBL30604653 0.78 KDM6B (0.51) KDM6BHSD17B10KDM4EUSP2EGFR
SCHEMBL30173222 0.76 TRPV1 (0.51) KDM6BHSD17B10KDM4EUSP2EGFR
SCHEMBL14836232 0.73 HSD17B10 (0.51) SERPINE1HSD17B10KDM4EHIF1ATRPV1
SCHEMBL471986 0.72 KDM6B (0.60) KDM6BHSD17B10KDM4EUSP2EGFR
SCHEMBL29794141 0.72 KDM6B (0.60) KDM6BHSD17B10KDM4EUSP2EGFR
SCHEMBL30093088 0.71 KDM6B (0.46) KDM6BHSD17B10KDM4EUSP2EGFR

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-2575896-A2 MAGNETICALLY RESPONSIVE MEMBRANE STRUCTURES Reimhult, Erik (AT) 2013-04-10 — — EP disclosed
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