SCHEMBL3250995

SCHEMBL3250995

CCCOC(=O)Oc1c[nH]c2c(=O)[nH]c3cc(F)c(S(=O)(=O)N(C)C4CC4)cc3c12

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.34
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 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
SCHEMBL3250779 0.91 PKM (0.34) PKMLMNAMAPTALDH1A1HPGD
SCHEMBL3249412 0.90
SCHEMBL3241908 0.87
SCHEMBL3251464 0.87 LMNA (0.36) PKMLMNAMAPTALDH1A1HPGD
SCHEMBL3255160 0.85 MAPT (0.38) LMNAMAPTALDH1A1HPGD
SCHEMBL3249777 0.83 ALOX5AP (0.33)
SCHEMBL3252606 0.81 ALDH1A1 (0.36) LMNAMAPTALDH1A1HPGD
SCHEMBL3245465 0.81 ALDH1A1 (0.36) LMNAMAPTALDH1A1HPGD
SCHEMBL3254901 0.80 KDM4E (0.38) LMNAMAPTALDH1A1HPGD
SCHEMBL3251021 0.80 MAPT (0.32) MAPTALDH1A1

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-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed