SCHEMBL22280456

SCHEMBL22280456

NC(CNO)c1ccc(Nc2cc(Br)ccc2Br)nc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.33
DHFR P00374 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
SCHEMBL22280476 0.75 AURKA (0.45)
SCHEMBL22280630 0.72 GRM5 (0.41) DHFR
SCHEMBL22265486 0.68 F10 (0.35) IGF1R
SCHEMBL22265485 0.68 F10 (0.35) IGF1R
SCHEMBL22280554 0.68 KDM4E (0.41)
SCHEMBL22265325 0.67 HTT (0.38) IGF1R
SCHEMBL3849741 0.60 SORT1 (0.45)
SCHEMBL21914358 0.59 TAAR1 (0.44)
SCHEMBL13874386 0.58 NPC1 (0.49)
SCHEMBL12067104 0.58 ALDH1A1 (0.46)

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
WO-2020154431-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY LYNCH KEVIN R (US) 2020-07-30 WO disclosed