SCHEMBL14432505

SCHEMBL14432505

CCCN(CCC)C1CCC(C)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 11/20 0.44
DRD2 P14416 6/20 0.44
DRD4 P21917 3/20 0.44
HTR1A P08908 1/20 0.40
FYN P06241 3/20 0.39
ALDH1A1 P00352 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL3376550 0.89 DRD3 (0.50) DRD3DRD2DRD4HTR1AFYN
SCHEMBL7058383 0.87 DRD3 (0.36) DRD3DRD2DRD4HTR1AFYN
SCHEMBL7855656 0.86 DRD3 (0.37) DRD3DRD2DRD4HTR1AFYN
SCHEMBL12957024 0.83 SIGMAR1 (0.37) DRD3DRD2DRD4MAPK1
SCHEMBL27445836 0.82 ADH1C (0.48) DRD3DRD2
SCHEMBL15865807 0.81 DRD3 (0.48) DRD3DRD2DRD4HTR1AFYN
SCHEMBL3374356 0.80 DRD3 (0.44) DRD3DRD2DRD4HTR1AFYN
SCHEMBL3370178 0.79
SCHEMBL18731298 0.79
SCHEMBL9246549 0.79

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
EP-3332645-A1 USE OF SUBSTITUTED PYRIMIDINE DIONES OR THEIR SALTS AS AGENTS TO COMBAT ABIOTIC PLANT STRESS Bayer Cropscience AG (DE) 2018-06-13 EP disclosed
EP-1818718-A2 Photothermographic material and method of thermal development of the same Fuji Photo Film Co., Ltd. (JP) 2007-08-15 EP disclosed
US-7186500-B2 Silver halide photographic lightsensitive material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-06 US disclosed
US-7186500-B2 Silver halide photographic lightsensitive material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-06 US disclosed