SCHEMBL479703

SCHEMBL479703

CCCN(C)Cc1ccc(N/C(=C2/C(=O)Nc3cc(C(=O)OCC)ccc32)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.41
GAA P10253 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAPT P10636 5/20 0.41
NAMPT P43490 1/20 0.41
SENP1 Q9P0U3 1/20 0.40
CETP P11597 4/20 0.40
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LTA4H P09960 1/20 0.38

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
SCHEMBL479707 1.00 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL479705 1.00 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL480868 0.94 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL480611 0.94 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL3157199 0.94 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2120229 0.94 RXFP1 (0.44) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2573260 0.94 RXFP1 (0.46) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL2573262 0.94 RXFP1 (0.46) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL479500 0.94 RXFP1 (0.42) RXFP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL479501 0.94 RXFP1 (0.42) 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