SCHEMBL21943197

SCHEMBL21943197

C=C(C)C1CCC2CC1c1c(O)cc(CCCCC)cc1O2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.61
▸ CNR2 P34972 8/20 0.52
▸ CNR1 P21554 5/20 0.52
▸ TRPV1 Q8NER1 2/20 0.52
▸ MLNR O43193 1/20 0.52
▸ NR1I2 O75469 1/20 0.52
▸ PDE9A O76083 1/20 0.52
▸ ABCB11 O95342 1/20 0.52
▸ LDHA P00338 1/20 0.52
▸ CYP1A1 P04798 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CHRM2 P08172 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ HTR1A P08908 1/20 0.52
▸ ADORA3 P0DMS8 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ DRD2 P14416 1/20 0.52
▸ ADRA2B P18089 1/20 0.52

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
SCHEMBL23791368 1.00 OPRM1 (0.61) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL25560744 0.97 OPRM1 (0.57) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL25560749 0.92 OPRM1 (0.51) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL25560752 0.92 OPRM1 (0.51) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL31545434 0.92 OPRM1 (0.51) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL23065024 0.85 OPRM1 (0.47) OPRM1CNR2CNR1
SCHEMBL13214083 0.80 OPRM1 (0.68) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL23868462 0.80 OPRM1 (0.68) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL16084557 0.80 OPRM1 (0.68) OPRM1CNR2CNR1TRPV1MLNR
SCHEMBL22821226 0.78 OPRM1 (0.78) OPRM1CNR2CNR1TRPV1MLNR

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-11654111-B2 Oral solid cannabinoid formulations, methods for producing and using thereof SATIPHARM AG (CH) 2023-05-23 — — US disclosed
US-20220151952-A1 Novel Nano-Formulation of Cannabidiol (CBD) and Other Cannabinoids for Treatment of Skin Diseases MILANE MICHAEL (US) 2022-05-19 — — US disclosed
US-20200121606-A1 ORAL SOLID CANNABINOID FORMULATIONS, METHODS FOR PRODUCING AND USING THEREOF GELPELL AG (CH) 2020-04-23 — — 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 (3 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-20220151952-A1 Novel Nano-Formulation of Cannabidiol (CBD) and Other Cannabinoids for Treatment of Skin Diseases CNR2, CNR1, NCSTN OPRM1 1395/4885CNR2 1/4885CNR1 2/4885
US-11654111-B2 Oral solid cannabinoid formulations, methods for producing and using thereof CNR2, CNR1, GPR18 OPRM1 18/4885CNR2 1/4885CNR1 2/4885
US-20200121606-A1 ORAL SOLID CANNABINOID FORMULATIONS, METHODS FOR PRODUCING AND USING THEREOF CNR2, CNR1, GPR18 OPRM1 18/4885CNR2 1/4885CNR1 2/4885

“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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