SCHEMBL10979486

SCHEMBL10979486

NC(=O)[C@@H]1CCCN1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.41
CNR1 P21554 4/20 0.41
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
OGFRL1 Q5TC84 1/20 0.36
AR P10275 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 4/20 0.33
EPHX1 P07099 2/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 2/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7021731 1.00 CNR2 (0.41) CNR2CNR1OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL28111340 0.98 CNR2 (0.40) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL7020161 0.98 CNR2 (0.40) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL15665283 0.92 CNR2 (0.35) CNR2CNR1ARPOLB
SCHEMBL16323018 0.92 CNR2 (0.35) CNR2CNR1ARPOLB
SCHEMBL15665554 0.92 CNR2 (0.35) CNR2CNR1ARPOLB
SCHEMBL31384866 0.90 CNR2 (0.35) CNR2CNR1ALDH1A1EPHX1TSHR
SCHEMBL28133681 0.83 CNR2 (0.43) CNR2CNR1SMN1; SMN2KDM4EALDH1A1
SCHEMBL5616564 0.83 ALDH1A1 (0.42) CNR2CNR1KDM4EALDH1A1
SCHEMBL5721034 0.83 CNR2 (0.46) CNR2CNR1POLB

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-4493828-A Use of thyrotropin releasing hormone and related peptides as poultry growth promotants MERCK & CO., INC. (US) 1985-01-15 US claimed
US-20140127762-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALPHA-SUBSTITUTED PROLINE API CORPORATION (JP) 2014-05-08 US disclosed
US-4493828-A Use of thyrotropin releasing hormone and related peptides as poultry growth promotants MERCK & CO., INC. (US) 1985-01-15 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 (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-20140127762-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALPHA-SUBSTITUTED PROLINE PREP, NPEPPS, DNPEP CNR2 3201/4885CNR1 2957/4885OPRM1 3962/4885

“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.