SCHEMBL600902

SCHEMBL600902

CC(C)(C)OC(=O)N1Cc2[nH]c3ccccc3c2C[C@]1(C)C(=O)N1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ FAAH O00519 3/20 0.41
▸ CYP19A1 P11511 4/20 0.41
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ BAZ2B Q9UIF8 1/20 0.40
▸ HTR1A P08908 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ ADRA1D P25100 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ ADRA1B P35368 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
SCHEMBL600901 1.00 TRPV1 (0.43) TRPV1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10122048 0.77 CYP19A1 (0.53) MEN1KMT2ACYP19A1
SCHEMBL600079 0.77 CYP19A1 (0.53) MEN1KMT2ACYP19A1
SCHEMBL600078 0.77 CYP19A1 (0.53) MEN1KMT2ACYP19A1
SCHEMBL21154454 0.74 LMNA (0.55) TRPV1MEN1KMT2AFAAHCYP19A1
SCHEMBL4540180 0.74 MAPT (0.59) TRPV1MEN1KMT2AKDM4EALDH1A1
SCHEMBL350201 0.74 TRPV1 (0.69) TRPV1FAAHLMNAMAPTBAZ2B
SCHEMBL602505 0.73 CNR2 (0.48) MEN1KMT2AKDM4EALDH1A1
SCHEMBL601532 0.73 CNR2 (0.48) MEN1KMT2AKDM4EALDH1A1
SCHEMBL601531 0.73 CNR2 (0.48) MEN1KMT2AKDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors THE UNIV OF MONTANA (US) 2017-04-06 — — US disclosed
US-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-02-16 — — 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-20120039804-A1 Novel Tricyclic Modulators of Cannabinoid Receptors CNR1, CNR2, OPRL1 TRPV1 4/4885MEN1 3607/4885KMT2A 1530/4885
US-20170096426-A1 Novel Tricyclic Modulators of Cannabinoid Receptors CNR1, CNR2, OPRL1 TRPV1 4/4885MEN1 3607/4885KMT2A 1530/4885

“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.

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