SCHEMBL6636153

SCHEMBL6636153

C1CCC(C2COCCO2)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL7737983 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7739529 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7741521 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL60853 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL7739260 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2177632 0.95 ALDH1A1 (0.30) ALDH1A1
SCHEMBL1777453 0.95 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11211959 0.95 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11797167 0.95 ALDH1A1 (0.30) ALDH1A1
SCHEMBL601589 0.95 ALDH1A1 (0.30) ALDH1A1

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-1278750-B1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-08-04 EP claimed
US-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed