SCHEMBL7274170

SCHEMBL7274170

CC1(C)Oc2ccc(C(N)=O)cc2C2(n3ccccc3=O)OC12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
F10 P00742 5/20 0.33
OPRM1 P35372 4/20 0.31
OPRK1 P41145 3/20 0.31
OPRD1 P41143 2/20 0.31
ABCC9 O60706 1/20 0.31
PDK2 Q15119 1/20 0.31
SLC9A1 P19634 1/20 0.30

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
SCHEMBL7277598 0.82 MAPT (0.40)
SCHEMBL7268514 0.80 ABCC9 (0.42) ABCC9
SCHEMBL8090456 0.72 ABCC9 (0.46) ABCC9
SCHEMBL8085308 0.70 ABCC9 (0.38) TSHRF10OPRM1OPRK1OPRD1
SCHEMBL9375674 0.65 F10 (0.39) TSHRF10PDK2
SCHEMBL8088453 0.65 F10 (0.33) TSHRF10OPRM1OPRK1ABCC9
SCHEMBL11395028 0.65 OPRM1 (0.38) TSHROPRM1OPRK1OPRD1
SCHEMBL7277331 0.64 F10 (0.40) TSHRF10OPRM1OPRK1OPRD1
SCHEMBL9738250 0.63 OPRM1 (0.36) TSHRF10OPRM1OPRK1OPRD1
SCHEMBL10694956 0.62 ABCC9 (0.41) ABCC9

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
EP-0346724-A1 Chroman derivates MERCK PATENT GmbH (DE) 1989-12-20 EP disclosed