SCHEMBL11368361

SCHEMBL11368361

COc1cccc(C(c2ccccc2)N2CCC(N)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 8/20 0.56
▸ OPRD1 P41143 7/20 0.56
▸ OPRK1 P41145 6/20 0.56
▸ OPRL1 P41146 6/20 0.56
▸ MAPT P10636 3/20 0.51
▸ MGLL Q99685 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ CACNA2D1 P54289 2/20 0.46
▸ CACNA1B Q00975 2/20 0.46
▸ CACNB1 Q02641 2/20 0.46
▸ LMNA P02545 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ L3MBTL3 Q96JM7 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL11369302 0.91 MGLL (0.47) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL11375998 0.87 OPRD1 (0.48) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL11377370 0.85 SMN1; SMN2 (0.44) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL8713092 0.84 OPRM1 (0.63) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL2306320 0.82 L3MBTL3 (0.61) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL11381417 0.82 OPRM1 (0.58) OPRM1OPRD1OPRK1OPRL1L3MBTL1
SCHEMBL6979086 0.81 OPRM1 (0.51) OPRM1OPRD1OPRK1OPRL1MAPT
Hydrochloric Acid SCHEMBL6984780 0.81 L3MBTL3 (0.59) OPRM1OPRD1OPRK1OPRL1L3MBTL1
SCHEMBL11375006 0.79 OPRD1 (0.49) OPRM1OPRD1OPRK1OPRL1MAPT
SCHEMBL11384079 0.79 ALDH1A1 (0.55) OPRM1OPRD1OPRK1OPRL1MAPT

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-4267318-A 1-(Diarylmethyl)-4-piperidinamine and derivatives thereof G. D. SEARLE & CO. (US) 1981-05-12 — — US disclosed
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