SCHEMBL9821695

SCHEMBL9821695

CC1(C)C=C(C2CCCCC2)NCC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.36
CCR2 P41597 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
SCHEMBL918438 0.66 NISCH (0.38) NISCH
SCHEMBL27451622 0.66 NISCH (0.38) NISCH
SCHEMBL27467506 0.63 NISCH (0.34) NISCH
SCHEMBL22510032 0.63 CCR2 (0.39) NISCHCCR2
SCHEMBL4274410 0.62 PTPN1 (0.37)
SCHEMBL16246596 0.60 CCR2 (0.36) NISCHCCR2
SCHEMBL17445293 0.60 EPHX2 (0.33)
SCHEMBL4267421 0.59 MAOA (0.36)
SCHEMBL6105380 0.57
SCHEMBL37603 0.57

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-0462123-A1 UV-ABSORBING COMPOUNDS AND COMPOSITIONS. ICI AUSTRALIA OPERATIONS (AU) 1991-12-27 EP disclosed
EP-0462123-A4 UV-ABSORBING COMPOUNDS AND COMPOSITIONS. ICI AUSTRALIA OPERATIONS (AU) 1991-11-06 EP disclosed
WO-1990009995-A1 UV-ABSORBING COMPOUNDS AND COMPOSITIONS ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) 1990-09-07 WO disclosed