SCHEMBL25511342

SCHEMBL25511342

COc1nc(-c2ccncc2)nc(Nc2ccc(C)cc2)c1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
ABCG2 Q9UNQ0 11/20 0.47
ABCB1 P08183 3/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ABCC1 P33527 1/20 0.46
MAPT P10636 4/20 0.41
TP53 P04637 2/20 0.41
LMNA P02545 1/20 0.41
PDE5A O76074 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 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
SCHEMBL24054977 0.89 ABCG2 (0.54) LATS1KDM4EALDH1A1RXFP1ABCG2
SCHEMBL25511339 0.86 MAPT (0.56) LATS1KDM4EALDH1A1RXFP1ABCG2
SCHEMBL25511346 0.83 LATS1 (0.54) LATS1KDM4EALDH1A1RXFP1ABCG2
SCHEMBL25511388 0.83 ABCG2 (0.39) LATS1KDM4EALDH1A1RXFP1ABCG2
SCHEMBL25511399 0.82 ABCG2 (0.41) KDM4EALDH1A1RXFP1ABCG2MAPT
SCHEMBL30151271 0.82 KDM1A (0.48) MEN1KMT2AMAPTTP53
SCHEMBL30151232 0.82 PTGS2 (0.42) LATS1ABCG2ABCB1MEN1KMT2A
SCHEMBL25511362 0.82 KDM1A (0.48) MEN1KMT2AMAPTTP53
SCHEMBL25511368 0.82 PTGS2 (0.42) LATS1ABCG2ABCB1MEN1KMT2A
SCHEMBL25511385 0.82 KDM1A (0.39) LATS1KDM4EALDH1A1RXFP1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504704-A Fluoropyrimidine compounds fluorine-containing pyrimidinone compound 优迈特株式会社 2025-02-25 CN disclosed
CN-115551840-B Fluoropyrimidine compounds fluorine-containing pyrimidinone compound 优迈特株式会社 2024-12-03 CN disclosed
CN-118251386-A Fluoropyrimidine compound, harmful fungus control agent, and process for producing fluoropyrimidine compound 优迈特株式会社 2024-06-25 CN disclosed
WO-2023085142-A1 FLUORINE-CONTAINING PYRIMIDINE COMPOUNDS, HARMFUL FUNGI CONTROL AGENT, AND METHOD FOR PRODUCING FLUORINE-CONTAINING PYRIMIDINE COMPOUNDS ユニマテック株式会社 2023-05-19 WO disclosed
CN-115551840-A Fluorine-containing pyrimidine compound and fluorine-containing pyrimidinone compound 优迈特株式会社 2022-12-30 CN disclosed