SCHEMBL31648508

SCHEMBL31648508

COc1cc(OC)cc(-c2cc3cnc(Cl)nc3cc2[N+](=O)[O-])c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 5/20 0.50
▸ FGFR4 P22455 3/20 0.48
▸ RPS6KB2 Q9UBS0 1/20 0.48
▸ FGFR1 P11362 10/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ SRC P12931 1/20 0.41
▸ FGFR2 P21802 1/20 0.38
▸ FGFR3 P22607 1/20 0.38

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
SCHEMBL31647667 0.81 FGFR4 (0.41) PIN1FGFR4RPS6KB2KDM4EALDH1A1
SCHEMBL16667808 0.80 FGFR1 (0.55) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL29385006 0.80 FGFR1 (0.55) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL29385053 0.79 KDM4E (0.65) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL15413235 0.79 KDM4E (0.65) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL31648407 0.79 PIN1 (0.57) PIN1FGFR4FGFR1KDM4EALDH1A1
SCHEMBL31647846 0.78 FGFR1 (0.59) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL29386366 0.78 FGFR1 (0.52) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL16668439 0.78 FGFR1 (0.52) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL28010166 0.78 KDM4E (0.63) FGFR4FGFR1KDM4EALDH1A1SMN1; SMN2

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
WO-2025132449-A1 NOVEL COMPOUNDS FOR HOST DIRECTED ANTIVIRAL STRATEGY SORBONNE UNIVERSITE (FR) 2025-06-26 — — WO disclosed
WO-2025133660-A1 NOVEL COMPOUNDS FOR HOST DIRECTED ANTIVIRAL STRATEGY SORBONNE UNIVERSITE (FR) 2025-06-26 — — WO disclosed
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