SCHEMBL9622327

SCHEMBL9622327

O=C(NC(=O)c1ccc(F)cc1Cl)Nc1cc(F)c(C(F)(F)F)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PYGL P06737 18/20 0.62
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL9622394 0.86 TDP1 (0.59) PYGLNPC1RAB9A
SCHEMBL10644317 0.85 PYGL (0.67) PYGLNPC1RAB9A
SCHEMBL9622399 0.84 PYGL (0.57) PYGLNPC1RAB9A
SCHEMBL10646104 0.81 PYGL (0.68) PYGLNPC1RAB9A
SCHEMBL10746618 0.79 PYGL (0.76) PYGLNPC1RAB9A
SCHEMBL10647027 0.78 PYGL (0.61) PYGLNPC1RAB9A
SCHEMBL9621862 0.78 TLR7 (0.62) NPC1RAB9A
SCHEMBL9622301 0.76 PYGL (0.61) PYGLNPC1RAB9A
SCHEMBL10745902 0.75 TDP1 (0.58) PYGLNPC1RAB9A
SCHEMBL9621859 0.75 MEN1 (0.50) NPC1RAB9A

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
US-5096928-A Caterpillars BAYER AKTIENGESELLSCHAFT (DE) 1992-03-17 US claimed