SCHEMBL6586984

SCHEMBL6586984

c1ccc(C[C]2CCCCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.52
POLB P06746 1/20 0.44
LTA4H P09960 6/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
IDH1 O75874 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
HRH1 P35367 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39

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
SCHEMBL2051544 1.00 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL1829180 1.00 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL2045801 0.97 CALM1 (0.55) CALM1POLBLTA4HIDH1HRH1
SCHEMBL1829354 0.92 CALM1 (0.55) CALM1LTA4HHRH3
SCHEMBL2973782 0.87 CALM1 (0.61) CALM1LTA4HIDH1
Diphenylmethane SCHEMBL28085719 0.81 CALM1 (0.80) CALM1LTA4HIDH1HRH3PLA2G10
Diphenylmethane SCHEMBL28072604 0.81 CALM1 (0.80) CALM1LTA4HIDH1HRH3PLA2G10
SCHEMBL438098 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL21807128 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL19306461 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023101004-A1 OLEFIN RESIN, METHOD FOR MANUFACTURING SAME, AND APPLICATION FOR SAME 三井化学株式会社 2023-06-08 WO disclosed
EP-0990653-B1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-09-15 EP disclosed
US-6258825-B1 ANALGESIC, A RELIEVER AGAINST TOLERANCE TO A NARCOTIC ANALGESIC REPRESENTED BY MORPHINE, REMEDY FOR PARKINSONISM, A REMEDY FOR CHOREA, AN ANTIDEPRESSANT, A REMEDY FOR DIABETES INSIPIDUS, A REMEDY FOR POLYURIA, OR HYPOTENSION BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-07-10 US disclosed
EP-0990653-A1 2-OXOIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-05 EP disclosed