SCHEMBL20116674

SCHEMBL20116674

CN1CCC(c2nc(-c3ccc4ccccc4n3)no2)CC1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMO Q99835 20/20 0.74

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
SCHEMBL2158684 0.82 SMO (0.78) SMO
SCHEMBL1834988 0.82 SMO (0.67) SMO
Hydrochloric Acid SCHEMBL1832477 0.81 SMO (0.66) SMO
SCHEMBL2158679 0.78 SMO (0.71) SMO
SCHEMBL2158643 0.77 SMO (1.00) SMO
SCHEMBL1841807 0.77 SMO (1.00) SMO
SCHEMBL20116326 0.76 SMO (0.69) SMO
SCHEMBL1831464 0.76 SMO (0.54) SMO
SCHEMBL30506340 0.76 SMO (0.69) SMO
SCHEMBL2158248 0.75 SMO (0.61) SMO

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 WO disclosed