SCHEMBL2179868

SCHEMBL2179868

CCCC(c1ccccc1)N1CC[C@H](N)[C@@H](O)C1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.50
OPRD1 P41143 12/20 0.50
OPRK1 P41145 12/20 0.50
OPRL1 P41146 12/20 0.50
DPP4 P27487 3/20 0.50
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MCHR1 Q99705 1/20 0.38
KCNA3 P22001 1/20 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
SCHEMBL2179875 1.00 OPRM1 (0.50) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2179872 1.00 OPRM1 (0.50) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2180510 0.90 DPP4 (0.48) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2180519 0.90 DPP4 (0.48) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2180514 0.90 DPP4 (0.48) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2178205 0.85 SLC6A4 (0.53) DPP4TSHR
SCHEMBL2178201 0.85 SLC6A4 (0.53) DPP4TSHR
SCHEMBL2178207 0.85 SLC6A4 (0.53) DPP4TSHR
SCHEMBL2179644 0.80 CYP2D6 (0.51) OPRM1OPRD1OPRK1OPRL1DPP4
SCHEMBL2179651 0.80 CYP2D6 (0.51) OPRM1OPRD1OPRK1OPRL1DPP4

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-2351738-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO)PIPERIDIN-3-OL Sumitomo Chemical Company, Limited (JP) 2011-08-03 EP disclosed
US-20110172431-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO) PIPERIDIN-3-OL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-14 US disclosed
US-20110166357-A1 METHOD FOR PRODUCING N-SUBSTITUTED-TRANS-4-AZIDOPIPERIDINE-3-OL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110166357-A1 METHOD FOR PRODUCING N-SUBSTITUTED-TRANS-4-AZIDOPIPERIDINE-3-OL RPS27L, OSGEP, RPLP1 OPRM1 29/4885OPRD1 40/4885OPRK1 53/4885
US-20110172431-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO) PIPERIDIN-3-OL TEAD4, TEAD3, TEAD2 OPRM1 134/4885OPRD1 83/4885OPRK1 302/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.