SCHEMBL17558338

SCHEMBL17558338

O=C1C[N+](Cc2ccnc3cccc(Cc4ccccn4)c23)(OC(=O)C(F)(F)F)C(=O)N1c1ccc(SC(F)(F)F)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL17558381 0.86 IGF1R (0.34) IGF1RSMN1; SMN2
SCHEMBL17558420 0.74 IGF1R (0.37) IGF1R
SCHEMBL17558364 0.74 IGF1R (0.40) IGF1R
SCHEMBL17558351 0.73 IGF1R (0.42) IGF1R
SCHEMBL3727095 0.73 IGF1R (0.34) IGF1RNPC1RAB9ASMN1; SMN2
SCHEMBL3726823 0.72 IGF1R (0.51) IGF1RSMN1; SMN2
SCHEMBL17558348 0.71 TACR1 (0.30)
SCHEMBL3727827 0.68 IGF1R (0.40) IGF1RSMN1; SMN2
SCHEMBL3728745 0.68 IGF1R (0.40) IGF1RSMN1; SMN2
SCHEMBL2942834 0.68 IGF1R (0.40) IGF1R

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
EP-3188729-A1 CYCLIC UREA COMPOUNDS AS TROPOMYOSIN-RELATED KINASE (TRK) INHIBITORS Genzyme Corporation (US) 2017-07-12 EP disclosed
WO-2016036796-A1 CYCLIC UREA COMPOUNDS AS TROPOMYOSIN-RELATED KINASE (TRK) INHIBITORS GENZYME CORPORATION (US) 2016-03-10 WO disclosed