SCHEMBL19880693

SCHEMBL19880693

CN1C(=O)[C@H](NC(=O)OC(C)(C)C)[C@H]2CC2c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 14/20 0.53
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SCN9A Q15858 4/20 0.41
KDM1A O60341 1/20 0.40
MAOB P27338 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
SCHEMBL30890790 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19224576 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19207938 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19228382 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19228384 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19228387 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL24991617 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19224577 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL19255505 1.00 RIPK1 (0.53) RIPK1KMT2AL3MBTL1SCN9AKDM1A
SCHEMBL20050170 0.86 RIPK1 (0.45) RIPK1KMT2AL3MBTL1SCN9A

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-9896458-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2018-02-20 US disclosed