SCHEMBL9950688

SCHEMBL9950688

CCC(CCN)C(C)CN

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 2/20 0.34
GABBR1 Q9UBS5 2/20 0.34
GABRR1 P24046 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 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
SCHEMBL19881386 0.86 GABRR1 (0.33) GABBR2GABBR1GABRR1
SCHEMBL9328511 0.86 GABRR1 (0.33) GABBR2GABBR1GABRR1ALDH1A1TDP1
SCHEMBL19669824 0.84 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL24484137 0.84 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL26736851 0.84 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL14812757 0.83 ALDH1A1 (0.35) ALDH1A1TDP1
SCHEMBL19295651 0.83 GABBR2 (0.37) GABBR2GABBR1GABRR1ALDH1A1
SCHEMBL22420341 0.83 GABRR1 (0.32) GABBR2GABBR1GABRR1ALDH1A1TDP1
SCHEMBL3097731 0.83
SCHEMBL26700358 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687555-B1 POLYAMIDE AND POLYAMIDE COMPOSITION ASAHI CHEMICAL IND (JP) 2016-12-14 EP disclosed
US-9090739-B2 Polyamide and polyamide composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-07-28 US disclosed
US-9023975-B2 Polyamide and polyamide composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-05-05 US disclosed
EP-2476717-B1 POLYAMIDE AND POLYAMIDE COMPOSITION ASAHI KASEI CHEMICALS CORP (JP) 2014-02-26 EP disclosed
US-20140039120-A1 POLYAMIDE AND POLYAMIDE COMPOSITION ASAHI KASEI CHEMICALS CORPORATION (JP) 2014-02-06 US disclosed
EP-2687555-A1 POLYAMIDE AND POLYAMIDE COMPOSITION Asahi Kasei Chemicals Corporation (JP) 2014-01-22 EP disclosed
EP-2476717-A1 POLYAMIDE AND POLYAMIDE COMPOSITION Asahi Kasei Chemicals Corporation (JP) 2012-07-18 EP disclosed
US-20120165466-A1 POLYAMIDE AND POLYAMIDE COMPOSITION ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-06-28 US disclosed
CN-102482415-A Polyamide and polyamide composition ASAHI KASEI CHEMICALS CORP (JP) 2012-05-30 CN disclosed