SCHEMBL10143570

SCHEMBL10143570

COc1ccc(Nc2nc(Cl)cc(N3CCC(C)CC3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GALR2 O43603 11/20 0.53
▸ GALR1 P47211 3/20 0.51
▸ MAPT P10636 3/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ AURKA O14965 1/20 0.48
▸ SLC2A1 P11166 1/20 0.46

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
SCHEMBL10143551 0.87 GALR2 (0.67) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10143394 0.87 GALR2 (0.67) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10144220 0.87 GALR2 (0.66) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10143457 0.83 MAPT (0.61) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10143742 0.83 JAK2 (0.53) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10143553 0.81 GALR2 (0.48) GALR2GALR1MAPTSMN1; SMN2MEN1
SCHEMBL10143440 0.79 KMT2A (0.54) GALR2MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL10144222 0.78 GALR1 (0.81) GALR2GALR1AURKA
SCHEMBL10143455 0.78 GALR2 (0.80) GALR2GALR1MAPTTP53AURKA
SCHEMBL27440444 0.77 LMNA (0.44) MAPTSMN1; SMN2MEN1KMT2AMAPK1

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
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