SCHEMBL28254689

SCHEMBL28254689

Cc1ccc(N/N=C/c2ccc(C(F)(F)F)nc2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.42
▸ KMT2A Q03164 8/20 0.42
▸ PKM P14618 1/20 0.40
▸ GFER P55789 2/20 0.38
▸ GAA P10253 8/20 0.38
▸ PLK1 P53350 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ RAD52 P43351 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ PAX8 Q06710 1/20 0.37
▸ MAPT P10636 7/20 0.37
▸ SLC2A1 P11166 1/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ LMNA P02545 5/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ HPGD P15428 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL28254764 0.85 PKM (0.39) MEN1KMT2APKMGFERGAA
SCHEMBL28254690 0.83 GFER (0.47) MEN1KMT2APKMGFERGAA
SCHEMBL28253899 0.80 MEN1 (0.42) MEN1KMT2APKMGFERGAA
SCHEMBL28254766 0.75 MEN1 (0.40) MEN1KMT2APKMGFERGAA
SCHEMBL28254732 0.74 GFER (0.46) MEN1KMT2APKMGFERGAA
SCHEMBL28255841 0.74 GFER (0.65) MEN1KMT2AGFERGAAPOLB
SCHEMBL25326639 0.73 ALDH1A1 (0.62) MEN1KMT2APOLBMAPTNPSR1
SCHEMBL30553383 0.73 ALDH1A1 (0.62) MEN1KMT2APOLBMAPTNPSR1
SCHEMBL28255840 0.73 GFER (0.45) MEN1KMT2APKMGFERGAA
SCHEMBL20581592 0.70 CYP1A2 (0.47) MEN1KMT2AGFERGAAMAPT

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-108863914-A The hydrazide derivatives and application thereof that pyridine replaces 广东东阳光药业有限公司 2018-11-23 — — CN disclosed
Send feedback