SCHEMBL22784451

SCHEMBL22784451

COC(=O)c1ccc2c(c1)[C@H](c1ccc(F)cc1)NCC2

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
KDM1A O60341 9/20 0.53
PRCP P42785 1/20 0.52
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
GID4 Q8IVV7 1/20 0.43
MAPKAPK2 P49137 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42

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
SCHEMBL29560484 1.00 MEN1 (0.65) MEN1KMT2AKDM1APRCPOPRM1
SCHEMBL30710370 0.88 MEN1 (0.65) MEN1KMT2AKDM1APRCPGID4
SCHEMBL22776238 0.85 KDM1A (0.53) MEN1KMT2AKDM1APRCPOPRM1
SCHEMBL29561026 0.85 KDM1A (0.53) MEN1KMT2AKDM1APRCPOPRM1
SCHEMBL22777145 0.85 KDM1A (0.53) MEN1KMT2AKDM1APRCPOPRM1
SCHEMBL22776035 0.85 KDM1A (0.60) MEN1KMT2AKDM1APRCPOPRM1
SCHEMBL30710254 0.82 KMT2A (0.59) MEN1KMT2AKDM1AOPRM1OPRD1
SCHEMBL3819993 0.79 MEN1 (0.53) MEN1KMT2AMAPKAPK2
SCHEMBL30710388 0.79 MEN1 (0.55) MEN1KMT2AKDM1AMAPKAPK2
SCHEMBL30710320 0.78 MEN1 (0.53) MEN1KMT2AKDM1APRCPOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113950477-B Granulin precursor modulators and methods of use thereof 阿库达医疗公司 2024-07-05 CN disclosed
WO-2020252222-A1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME ARKUDA THERAPEUTICS (US) 2020-12-17 WO disclosed