SCHEMBL24344259

SCHEMBL24344259

COCc1nn(Cc2ccc(C)cc2)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 17/20 0.48
KMT2A Q03164 1/20 0.46
RAB9A P51151 1/20 0.45
DUSP3 P51452 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL16246727 0.89 KLKB1 (0.59) KLKB1
SCHEMBL370508 0.88 KMT2A (0.53) KLKB1KMT2ARAB9A
SCHEMBL31352698 0.84 KLKB1 (0.44) KLKB1KMT2A
SCHEMBL17786881 0.84 KLKB1 (0.64) KLKB1
SCHEMBL17786993 0.83 KLKB1 (0.52) KLKB1
SCHEMBL17787030 0.81 KLKB1 (0.46) KLKB1
SCHEMBL17784852 0.81 KLKB1 (0.67) KLKB1
SCHEMBL22491808 0.80 KLKB1 (0.64) KLKB1
SCHEMBL26227498 0.79 F11 (0.44) KLKB1RAB9A
SCHEMBL16246944 0.78 KLKB1 (0.55) KLKB1

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-2022079446-A1 TREATMENTS OF ANGIOEDEMA KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-04-21 WO disclosed