SCHEMBL31252452

SCHEMBL31252452

O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NC(C(=O)Nc1ccc(F)cc1F)c1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 2/20 0.56
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
P2RX1 P51575 1/20 0.44
TMPRSS4 Q9NRS4 1/20 0.44
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 1/20 0.41
TACR1 P25103 1/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
KDM4E B2RXH2 1/20 0.40
KLK7 P49862 1/20 0.40
BRAF P15056 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
SCHEMBL31252496 0.84 POLB (0.49) ULK1PKMSMN1; SMN2NPC1RAB9A
SCHEMBL31252380 0.84 POLB (0.49) ULK1PKMSMN1; SMN2NPC1RAB9A
SCHEMBL20418419 0.80 ULK1 (0.85) ULK1PKMSMN1; SMN2NPC1RAB9A
SCHEMBL29520034 0.80 ULK1 (0.85) ULK1PKMSMN1; SMN2NPC1RAB9A
SCHEMBL30745220 0.80 ULK1 (0.85) ULK1PKMSMN1; SMN2NPC1RAB9A
SCHEMBL16621348 0.78 P2RX1 (0.55) SMN1; SMN2NPC1RAB9AHTTP2RX1
SCHEMBL5950442 0.77 ULK1 (0.50) ULK1SMN1; SMN2RAB9AHTTP2RX1
SCHEMBL16628079 0.70 MAPT (0.51) SMN1; SMN2NPC1RAB9AHTTP2RX1
SCHEMBL16628060 0.70 CA12 (0.66) RAB9AHTTP2RX1KMT2AGAA
SCHEMBL1894047 0.68 RAB9A (0.66) PKMSMN1; SMN2NPC1RAB9AHTT

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-4713017-A1 CHIMERIC MOLECULE UCL Business Ltd (GB) 2026-03-25 EP disclosed
WO-2024236326-A1 CHIMERIC MOLECULE UCL BUSINESS LTD (GB) 2024-11-21 WO disclosed