SCHEMBL31351997

SCHEMBL31351997

Cn1cnc2cc(Oc3ccc(N)cc3Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
FGFR1 P11362 2/20 0.43
HPGD P15428 2/20 0.43
GAA P10253 2/20 0.43
PDE7A Q13946 1/20 0.41
EGFR P00533 2/20 0.41
ERBB2 P04626 2/20 0.41
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GFER P55789 1/20 0.38
MEN1 O00255 2/20 0.38

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
SCHEMBL23750376 1.00 KMT2A (0.43) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL1191996 0.86 KMT2A (0.46) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL29888756 0.85 KMT2A (0.43) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL23750358 0.85 KMT2A (0.43) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL31476147 0.85 MAPT (0.49) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL23750359 0.85 KMT2A (0.43) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL23750375 0.85 MAPT (0.49) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL23750362 0.84 KMT2A (0.45) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL24569506 0.82 FGFR1 (0.54) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1
SCHEMBL30050677 0.82 GRM5 (0.43) KMT2AMAPTALDH1A1SMN1; SMN2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025051148-A1 NITROGEN-CONTAINING HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 北京鞍石生物科技股份有限公司 2025-03-13 WO disclosed
CN-119320383-A Nitrogen-containing heteroaryl compound, and preparation method and application thereof 北京鞍石生物科技股份有限公司 2025-01-17 CN disclosed