SCHEMBL30762452

SCHEMBL30762452

NC(=O)C1CCOC(c2c(Br)cc(F)cc2C(=O)CC2CC2)C1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.31

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
SCHEMBL30762367 0.88 KDM4E (0.30)
SCHEMBL30762495 0.71 DRD2 (0.37)
SCHEMBL30762630 0.68 HDAC1 (0.41) OPRL1
SCHEMBL8410875 0.67 HCAR1 (0.32)
SCHEMBL30762527 0.65 KMT2A (0.34)
SCHEMBL8408803 0.60 KCNH2 (0.44)
SCHEMBL9940281 0.60 TSHR (0.41)
SCHEMBL16946745 0.59 PIN1 (0.46)
SCHEMBL29992422 0.59 PIN1 (0.46)
SCHEMBL18527239 0.58 DRD2 (0.51)

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-2024026423-A1 SUBSTITUTED QUINOLINE DERIVATIVES AS PI3K INHIBITORS BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed