SCHEMBL16735594

SCHEMBL16735594

N#CCCN(CC1CCCO1)C(=O)c1cc2ncccc2cc1O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ OXTR P30559 7/20 0.41
▸ AVPR1A P37288 6/20 0.41
▸ MAPT P10636 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL2143866 0.83 BCHE (0.47) MEN1KMT2AOXTRAVPR1AMAPT
SCHEMBL16735603 0.76 TSHR (0.44) MAPTALDH1A1KDM4E
SCHEMBL12443455 0.68 PDE4A (0.47) KMT2AOXTRAVPR1AALDH1A1PDE4A
SCHEMBL16735591 0.67 HSD11B1 (0.53) RAB9ANPC1POLB
SCHEMBL16735622 0.66 POLB (0.53) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL13612605 0.66 PDE4A (0.45) KMT2AOXTRAVPR1AMAPTALDH1A1
SCHEMBL15659780 0.66 PSMD14 (0.49) MEN1KMT2ANPC1OXTRAVPR1A
SCHEMBL6358384 0.66 L3MBTL1 (0.45) MEN1KMT2ARAB9ANPC1OXTR
SCHEMBL13605180 0.65 PDE4A (0.44) OXTRAVPR1AALDH1A1PDE4APDE4B
SCHEMBL16735660 0.65 L3MBTL1 (0.54) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2

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
EP-2519505-B1 TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF POLICHEM SA (LU) 2015-05-27 — — EP claimed
Send feedback