SCHEMBL11240962

SCHEMBL11240962

CCOC(=O)c1ccc(NCc2cccc(Br)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
ALDH1A1 P00352 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
LMNA P02545 2/20 0.59
USP2 O75604 1/20 0.59
ALOX15 P16050 1/20 0.59
HSD17B10 Q99714 1/20 0.59
RAB9A P51151 6/20 0.58
NPC1 O15118 5/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
FFAR1 O14842 1/20 0.56
FFAR4 Q5NUL3 1/20 0.56
SENP1 Q9P0U3 1/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
SLC26A6 Q9BXS9 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
NAMPT P43490 1/20 0.52
MAPK1 P28482 2/20 0.49

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
SCHEMBL4748570 0.88 CA1 (0.69) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL11253249 0.85 TRPV1 (0.64) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL11247812 0.84 MAPT (0.71) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL5068509 0.84 CA1 (0.75) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL11246781 0.82 FFAR1 (0.60) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL11253864 0.81 FFAR1 (0.68) MAPTFFAR1FFAR4CA1CA2
SCHEMBL11246229 0.81 MAPT (0.55) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL20334066 0.79 RAB9A (0.64) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL11252769 0.79 HKDC1 (0.60) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL4051167 0.78 MAPT (0.75) MAPTALDH1A1MEN1KMT2ALMNA

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
US-4362892-A ARALKYLANILINES, ANTICHOLESTEROL AGENTS BEECHAM GROUP LIMITED (GB) 1982-12-07 US disclosed
US-4206145-A ALKANOYL-SUBSTITUTED ARALKYLAMINES BEECHAM GROUP LIMITED (GB) 1980-06-03 US disclosed