SCHEMBL23616971

SCHEMBL23616971

CCCCC(=O)NCc1cccc(Cl)c1F

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.74
P2RX7 Q99572 4/20 0.54
HPGD P15428 2/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.47
EPHX2 P34913 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL6649890 0.86 HTT (0.78) HTTP2RX7HPGDALDH1A1KMT2A
SCHEMBL18967804 0.85 P2RX7 (0.58) HTTP2RX7HPGDALDH1A1KMT2A
SCHEMBL19208154 0.81 P2RX7 (0.53) HTTP2RX7KMT2A
SCHEMBL29781846 0.81 P2RX7 (0.53) HTTP2RX7KMT2A
SCHEMBL19208424 0.81 P2RX7 (0.56) HTTP2RX7ALDH1A1KMT2A
SCHEMBL19208100 0.81 P2RX7 (0.55) HTTP2RX7KMT2A
SCHEMBL29781973 0.81 P2RX7 (0.55) HTTP2RX7KMT2A
SCHEMBL19208108 0.80 P2RX7 (0.56) HTTP2RX7KMT2A
SCHEMBL29781841 0.80 P2RX7 (0.56) HTTP2RX7KMT2A
SCHEMBL19208558 0.80 P2RX7 (0.55) HTTP2RX7KMT2A

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-3687506-B1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS BIOCRYST PHARM INC (US) 2021-07-07 EP disclosed