SCHEMBL29635357

SCHEMBL29635357

COc1nc(-c2ncc(Br)cn2)nc(F)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 1/20 0.33
KMT2A Q03164 2/20 0.32
PPP1CA P62136 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
SCHEMBL22042755 1.00 ULK1 (0.33) ULK1KMT2APPP1CA
SCHEMBL29635375 0.88 KMT2A (0.33) KMT2APPP1CA
SCHEMBL22042753 0.88 KMT2A (0.33) KMT2APPP1CA
Hydrochloric Acid SCHEMBL22042763 0.87
SCHEMBL22042736 0.83 GAA (0.35) ULK1KMT2APPP1CA
SCHEMBL29635367 0.83 GAA (0.35) ULK1KMT2APPP1CA
SCHEMBL22042756 0.79 HDAC1 (0.36) ULK1KMT2A
SCHEMBL29635368 0.79 HDAC1 (0.36) ULK1KMT2A
SCHEMBL30421024 0.79 HDAC1 (0.36) ULK1KMT2A
Hydrochloric Acid SCHEMBL22042739 0.76

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
CN-112739689-B Fluorine-containing pyrimidine compound and method for producing same 优迈特株式会社 2022-06-03 CN disclosed