SCHEMBL11244854

SCHEMBL11244854

CCOC(=O)c1cnc2c(N(C)C)cccc2c1Cl

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ MAPT P10636 5/20 0.49
▸ POLB P06746 3/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ RAD52 P43351 2/20 0.45
▸ UHRF1 Q96T88 1/20 0.44

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
SCHEMBL11240035 0.86 KMT2A (0.48) KMT2AMEN1MAPTPOLBNPC1
SCHEMBL2020438 0.85 KMT2A (0.71) KMT2AMEN1MAPTPOLBNPC1
SCHEMBL2017369 0.85 KMT2A (0.71) KMT2AMEN1MAPTPOLBNPC1
SCHEMBL2021172 0.84 KMT2A (0.70) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL6537339 0.82 KMT2A (0.68) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL6293263 0.82 KMT2A (0.68) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL11244456 0.82 MEN1 (0.68) KMT2AMEN1MAPT
SCHEMBL6289957 0.82 KMT2A (0.68) KMT2AMEN1MAPTPOLBNPC1
SCHEMBL2719292 0.82 KMT2A (0.68) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL774503 0.81 MEN1 (0.67) KMT2AMEN1MAPTALDH1A1SMN1; 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
US-4343804-A 4-Amino-3-quinolinecarboxylic acids and esters-antisecretory anti-ulcer compounds A. H. ROBINS COMPANY, INC. (US) 1982-08-10 — — US disclosed
Send feedback