SCHEMBL480902

SCHEMBL480902

CC(C)(N)c1ccc(N/C(=C2/C(=O)Nc3cc(C(=O)OCCN)ccc32)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.37
GAA P10253 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 6/20 0.37
BACE1 P56817 2/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CA12 O43570 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ALDH1A1 P00352 4/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
TP53 P04637 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL2571213 1.00 RXFP1 (0.40) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL3155804 0.93 RXFP1 (0.40) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL3143809 0.92 RXFP1 (0.42) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2573629 0.91 RXFP1 (0.49) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL3161556 0.91 KDM4E (0.41) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2570006 0.90 RXFP1 (0.41) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2571162 0.90 MAPT (0.41) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2568537 0.89 KMT2A (0.43) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL3157321 0.89 RXFP1 (0.40) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2568413 0.87 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A

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
EP-2411034-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS Life & Brain GmbH (DE) 2012-02-01 EP disclosed
WO-2010108665-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS LIFE & BRAIN GMBH (DE) 2010-09-30 WO disclosed