SCHEMBL10143796

SCHEMBL10143796

COc1ccc(Nc2cc(Nc3ccccc3)nc(N3CCCCC3)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 14/20 1.00
GALR1 P47211 7/20 1.00
TAAR1 Q96RJ0 2/20 0.60
MAPK1 P28482 1/20 0.60
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
LMNA P02545 3/20 0.56
MAPT P10636 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
HTT P42858 2/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
HPGD P15428 1/20 0.56
ALOX12 P18054 1/20 0.56
CYP2C19 P33261 1/20 0.56
RECQL P46063 1/20 0.56

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
SCHEMBL10144392 0.93 GALR2 (1.00) GALR2GALR1TAAR1MAPK1KMT2A
SCHEMBL10143418 0.93 GALR2 (0.86) GALR2GALR1TAAR1MAPK1KMT2A
SCHEMBL10144388 0.90 GALR2 (1.00) GALR2GALR1TAAR1MAPK1KMT2A
SCHEMBL10143549 0.87 GALR2 (0.77) GALR2GALR1TAAR1MAPK1KMT2A
SCHEMBL10144339 0.87 GALR2 (0.82) GALR2GALR1TAAR1MAPK1MAPT
SCHEMBL10143413 0.85 GALR2 (1.00) GALR2GALR1TAAR1MAPK1MAPT
SCHEMBL10144177 0.85 GALR2 (0.82) GALR2GALR1TAAR1MAPK1KMT2A
SCHEMBL10143419 0.84 GALR2 (0.81) GALR2GALR1TAAR1MAPK1ALDH1A1
SCHEMBL10143797 0.84 GALR2 (0.83) GALR2GALR1LMNANPSR1
SCHEMBL10144390 0.84 GALR2 (0.81) GALR2GALR1TAAR1MAPK1

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