SCHEMBL9640923

SCHEMBL9640923

CC1CCC(Oc2ccc(OC3CCC(C)CC3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.43
HRH3 Q9Y5N1 5/20 0.43
PARP10 Q53GL7 1/20 0.42
PTPN1 P18031 1/20 0.42
MCHR1 Q99705 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
CHRNA10 Q9GZZ6 1/20 0.40
CHRNA9 Q9UGM1 1/20 0.40
MAPT P10636 1/20 0.40
SLC6A4 P31645 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
ACACB O00763 1/20 0.38
FFAR1 O14842 1/20 0.38
EPHX2 P34913 2/20 0.38

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
SCHEMBL20196968 0.91 FPR2 (0.40) HRH1HRH3PARP10PTPN1MCHR1
SCHEMBL12056318 0.91 MCHR1 (0.44) HRH1HRH3PARP10PTPN1MCHR1
SCHEMBL12807880 0.91 FPR2 (0.40) HRH1HRH3PARP10PTPN1MCHR1
SCHEMBL5722066 0.89 EPHX2 (0.50) MCHR1EPHX2
SCHEMBL14654961 0.89 HRH1 (0.59) HRH1MCHR1SMN1; SMN2CHRNB2CHRNB4
SCHEMBL1931211 0.89 HRH1 (0.59) HRH1MCHR1SMN1; SMN2CHRNB2CHRNB4
SCHEMBL8273726 0.86 HRH3 (0.47) HRH1HRH3PTPN1ACACB
SCHEMBL13439689 0.86 ACACB (0.44) HRH3ACACBFFAR1
SCHEMBL13110232 0.86 NPY1R (0.50) HRH3SMN1; SMN2MAPTACACB
SCHEMBL19557076 0.86 FPR2 (0.41) HRH1HRH3PARP10PTPN1MCHR1

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-0370054-B1 CATALYST COMPOSITION AND METHOD FOR SELECTIVE DEHYDROGENATION EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-01-15 EP claimed
EP-0370054-A1 CATALYST COMPOSITION AND METHOD FOR SELECTIVE DEHYDROGENATION. EASTMAN KODAK CO (US) 1990-05-30 EP claimed
WO-1989000452-A1 CATALYST COMPOSITION AND METHOD FOR SELECTIVE DEHYDROGENATION EASTMAN KODAK COMPANY (US) 1989-01-26 WO claimed