SCHEMBL28254764

SCHEMBL28254764

Cc1ccc(N/N=C/c2cnc(C(F)(F)F)nc2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.39
▸ KMT2A Q03164 6/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ MAPT P10636 6/20 0.38
▸ LMNA P02545 5/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ GFER P55789 2/20 0.37
▸ GAA P10253 9/20 0.37
▸ POLB P06746 1/20 0.36
▸ RAD52 P43351 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36

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
SCHEMBL28253899 0.85 MEN1 (0.42) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28254689 0.85 MEN1 (0.42) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28254766 0.80 MEN1 (0.40) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28254690 0.80 GFER (0.47) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28254732 0.79 GFER (0.46) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28255840 0.75 GFER (0.45) PKMKMT2AMEN1MAPTLMNA
SCHEMBL28255841 0.73 GFER (0.65) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL28254744 0.72 GAA (0.49) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL28254787 0.69 KMT2A (0.49) PKMKMT2AMEN1MAPTLMNA
SCHEMBL19563021 0.68 KMT2A (0.40) PKMKMT2AMEN1MAPTLMNA

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-108863948-A The hydrazide derivatives and application thereof that pyrimidine replaces 广东东阳光药业有限公司 2018-11-23 — — CN disclosed
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