SCHEMBL20473402

SCHEMBL20473402

C(CCCNC(=NC1CCCCC1)NC1CCCCC1)CCNC(=NC1CCCCC1)NC1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.61
EPHX1 P07099 11/20 0.53
EPHX2 P34913 3/20 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
SCHEMBL22068780 1.00 SIGMAR1 (0.61) SIGMAR1EPHX1EPHX2
SCHEMBL22068836 1.00 SIGMAR1 (0.61) SIGMAR1EPHX1EPHX2
SCHEMBL22068776 1.00 SIGMAR1 (0.61) SIGMAR1EPHX1EPHX2
SCHEMBL20473401 0.98 SIGMAR1 (0.63) SIGMAR1EPHX1EPHX2
SCHEMBL17187339 0.95 EPHX1 (0.60) SIGMAR1EPHX1EPHX2
SCHEMBL17187374 0.95 EPHX1 (0.60) SIGMAR1EPHX1EPHX2
SCHEMBL20185668 0.95 SIGMAR1 (0.56) SIGMAR1EPHX1EPHX2
SCHEMBL17187340 0.95 EPHX1 (0.60) SIGMAR1EPHX1EPHX2
SCHEMBL17187373 0.95 EPHX1 (0.60) SIGMAR1EPHX1EPHX2
SCHEMBL20473411 0.95 SIGMAR1 (0.63) SIGMAR1EPHX1EPHX2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3362491-B1 CATALYST SYSTEM FOR CURABLE COMPOSITIONS BASED ON POLYMERS CONTAINING SILANE GROUPS SIKA TECH AG (CH) 2020-07-29 EP disclosed
EP-3131992-B1 FAST CURING MIGRATION-FREE COMPOSITION BASED ON POLYMERS CONTAINING SILANE GROUPS SIKA TECH AG (CH) 2020-06-17 EP disclosed
EP-3362491-A1 CATALYST SYSTEM FOR CURABLE COMPOSITIONS BASED ON POLYMERS CONTAINING SILANE GROUPS Sika Technology AG (CH) 2018-08-22 EP disclosed