SCHEMBL373863

SCHEMBL373863

COc1ccc(-c2cc(NCCCN)c3cc(-c4ccccc4)cnc3n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.69
ACP1 P24666 13/20 0.51
TACR3 P29371 1/20 0.47

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
SCHEMBL588994 0.82 SYK (1.00) SYK
SCHEMBL23015135 0.82 ACP1 (0.73) SYKACP1
SCHEMBL29636689 0.82 ACP1 (0.73) SYKACP1
SCHEMBL29636697 0.78 ACP1 (0.68) SYKACP1
SCHEMBL23015121 0.78 ACP1 (0.68) SYKACP1
Hydrochloric Acid SCHEMBL23015090 0.78 ACP1 (0.67) SYKACP1
Hydrochloric Acid SCHEMBL29636794 0.78 ACP1 (0.67) SYKACP1
SCHEMBL23015208 0.75 ACP1 (0.63) SYKACP1
SCHEMBL23029741 0.75 SYK (0.62) SYKACP1
SCHEMBL29874547 0.75 SYK (0.62) SYKACP1

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
EP-2215092-B1 SUBSTITUTED PIPERIDINO-DIHYDROTHIENOPYRIMIDINES BOEHRINGER INGELHEIM INT (DE) 2012-01-25 EP disclosed