SCHEMBL25166204

SCHEMBL25166204

Bc1c(F)c(N)cc2c1OCC2

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.42
PRKCI P41743 1/20 0.31
CYP2A6 P11509 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
SCHEMBL25166010 0.79 PARP1 (0.42) PARP1PRKCICYP2A6
SCHEMBL6637296 0.72 PARP1 (0.59) PARP1PRKCI
SCHEMBL29661355 0.72 PARP1 (0.59) PARP1PRKCI
SCHEMBL25166593 0.69 PARP1 (0.34) PARP1
SCHEMBL1976575 0.68 PARP1 (0.46) PARP1PRKCI
SCHEMBL31107976 0.66 PARP1 (0.33) PARP1
SCHEMBL25166146 0.66 PARP1 (0.37) PARP1CYP2A6
SCHEMBL13705933 0.64 PARP1 (0.36) PARP1CYP2A6
SCHEMBL23363798 0.64 GAA (0.33) PARP1
SCHEMBL25166014 0.64 PARP1 (0.36) PARP1

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-2023064586-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-04-20 WO disclosed