SCHEMBL11399201

SCHEMBL11399201

CC(C(=O)N(C)C)C1(O)CCN(C(CCC=O)c2ccc(F)cc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.37
DPP4 P27487 7/20 0.36
DPP7 Q9UHL4 4/20 0.36
DPP9 Q86TI2 3/20 0.36
DPP8 Q6V1X1 2/20 0.36
KCNH2 Q12809 1/20 0.36
OPRM1 P35372 2/20 0.35
OPRD1 P41143 2/20 0.35
OPRK1 P41145 2/20 0.35
OPRL1 P41146 2/20 0.35
CCR3 P51677 1/20 0.35
MC4R P32245 3/20 0.34
MC1R Q01726 1/20 0.34
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL23883211 0.73 DRD2 (0.55) KCNH2OPRM1OPRD1OPRK1OPRL1
SCHEMBL5820396 0.73 DRD2 (0.55) KCNH2OPRM1OPRD1OPRK1OPRL1
SCHEMBL20529619 0.71 TSHR (0.40) DPP4DPP7DPP8KCNH2OPRM1
SCHEMBL3676873 0.71 TSHR (0.40) DPP4DPP7DPP8KCNH2OPRM1
SCHEMBL10935924 0.70 MC4R (0.41) OPRD1CCR3MC4RMC1R
SCHEMBL11399203 0.68 DRD2 (0.61) KCNH2OPRM1OPRK1MC4R
SCHEMBL10677826 0.67 OPRL1 (0.37) P2RX7OPRM1OPRD1OPRK1OPRL1
Hydrochloric Acid SCHEMBL10936692 0.66 MC4R (0.43) CCR3MC4RMC1R
SCHEMBL10530556 0.65 OPRM1 (0.69) KCNH2OPRM1OPRD1OPRK1OPRL1
SCHEMBL11401962 0.63 CYP2D6 (0.55) OPRL1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4248877-A ANTIDEPRESSANTS, ANALGESICS, ANTIMIGRAINE AGENTS SANDOZ LTD. (CH) 1981-02-03 US claimed