SCHEMBL7239446

SCHEMBL7239446

CC(c1ccccc1)N1C[C@@H]2O[C@H]2C1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.59
MC4R P32245 1/20 0.52
OPRM1 P35372 3/20 0.44
OPRK1 P41145 2/20 0.44
OPRL1 P41146 2/20 0.44
OPRD1 P41143 1/20 0.44
CCR5 P51681 1/20 0.43
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.39

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
SCHEMBL7234096 1.00 CYP2D6 (0.59) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL11478237 1.00 CYP2D6 (0.59) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL7234103 1.00 CYP2D6 (0.59) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL7239440 1.00 CYP2D6 (0.59) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL2177322 0.88 CYP2D6 (0.55) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL6097455 0.82 CYP2D6 (0.65) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL48088 0.78 CYP2D6 (0.61) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL2916607 0.78 CYP2D6 (0.61) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL9596277 0.78 CYP2D6 (0.61) CYP2D6MC4ROPRM1OPRK1OPRL1
SCHEMBL2921816 0.78 CYP2D6 (0.61) CYP2D6MC4ROPRM1OPRK1OPRL1

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
US-6620945-B2 Squalene synthetase inhibitors; antilipemic agents, anticholesterol agents EISAI CO., LTD. (JP) 2003-09-16 US disclosed
US-20030004208-A1 Process for producing stereoisomer of pyrrolidine derivative EISAI CO., LTD. (JP) 2003-01-02 US disclosed
EP-1256573-A1 Process for producing stereoisomer of pyrrolidine derivative Eisai Co., Ltd. (JP) 2002-11-13 EP 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 (1 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-20030004208-A1 Process for producing stereoisomer of pyrrolidine derivative DHPS, SQLE, FDFT1 CYP2D6 1174/4885MC4R 1179/4885OPRM1 2738/4885

“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.