SCHEMBL30065244

SCHEMBL30065244

O=C(N[C@@H]1CCOC1)c1ccc(N2CCN(C(=O)O)CC2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 7/20 0.55
▸ NAMPT P43490 6/20 0.49
▸ HPGD P15428 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ BRAF P15056 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL29085167 0.86 USP30 (0.62) USP30NAMPTHPGDNPC1ALOX15
SCHEMBL29115493 0.86 USP30 (0.62) USP30NAMPTHPGDNPC1ALOX15
SCHEMBL29085260 0.86 USP30 (0.62) USP30NAMPTHPGDNPC1ALOX15
SCHEMBL29960478 0.86 USP30 (0.56) USP30NAMPTHPGDSMN1; SMN2NPC1
SCHEMBL29085175 0.86 USP30 (0.56) USP30NAMPTHPGDSMN1; SMN2NPC1
SCHEMBL29085200 0.86 USP30 (0.56) USP30NAMPTHPGDSMN1; SMN2NPC1
SCHEMBL29085179 0.86 USP30 (0.56) USP30NAMPTHPGDSMN1; SMN2NPC1
SCHEMBL29085171 0.84 USP30 (0.48) USP30NAMPTHPGDSMN1; SMN2NPC1
SCHEMBL29115445 0.76 NAMPT (0.52) USP30NAMPTNPC1RAB9ABRAF
SCHEMBL29115443 0.76 NAMPT (0.52) USP30NAMPTNPC1RAB9ABRAF

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
WO-2022222964-A1 PYRIDINE DERIVATIVE AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2022-10-27 — — WO disclosed
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