SCHEMBL7934060

SCHEMBL7934060

FC1CCNCCCNCCCNCCCN1[Ti]

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 6/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7935067 0.75 CXCR4 (0.32) CXCR4SMN1; SMN2
SCHEMBL7936313 0.75
SCHEMBL7938168 0.72
Hydrochloric Acid SCHEMBL7935061 0.69 CXCR4 (0.44) CXCR4SMN1; SMN2
SCHEMBL8678476 0.68 CHRNB2 (0.32)
SCHEMBL7934531 0.66 CXCR4 (0.47) CXCR4SMN1; SMN2
Hydrochloric Acid SCHEMBL7935084 0.66 CXCR4 (0.39) CXCR4SMN1; SMN2
SCHEMBL7935032 0.65 ALDH1A1 (0.31)
SCHEMBL9177626 0.61 CXCR4 (0.47) CXCR4SMN1; SMN2
SCHEMBL20882990 0.61 CXCR4 (0.47) CXCR4SMN1; SMN2

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
US-6169152-B1 COPOLYMER OF ETHYLENE AND A POLAR GROUP-CONTAINING CYCLIC OLEFIN COMPRISING ESTER- OR ANHYDRIDE MODIFIED NORBORNENE OR PERHYDRO-2,3-DIDEHYDRO-1,4:5,8-DIMETHANONAPHTHALENE MADE WITH CATALYST SUCH AS 1,5,9-TRIAZACYCLODODECANYLTITANIUM CHLORIDE JSR CORPORATION (JP) 2001-01-02 US disclosed
EP-0816387-A1 Olefin-polymerizing catalyst JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1998-01-07 EP disclosed