SCHEMBL7222216

SCHEMBL7222216

COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn(CCN2CCOCC2)cn1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.59
CNR1 P21554 1/20 0.55
HSP90AA1 P07900 1/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
POLB P06746 1/20 0.47
GFER P55789 1/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
CDK2 P24941 1/20 0.46
TACR2 P21452 3/20 0.46
GAA P10253 2/20 0.45

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
SCHEMBL7216944 0.82 RAB9A (0.53) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL7223441 0.82 RAB9A (0.51) CNR2CNR1CYP2C9CYP2C19POLB
SCHEMBL7223448 0.76 CNR2 (0.65) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL7217580 0.76 CNR2 (0.69) CNR2CNR1CYP3A4CYP2D6CYP2C9
SCHEMBL7224460 0.74 CNR2 (1.00) CNR2CNR1
SCHEMBL7268468 0.74 POLB (0.76) CNR2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL7268474 0.74 POLB (0.76) CNR2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL7216889 0.73 CNR2 (0.66) CNR2CNR1HSP90AA1CYP3A4CYP2D6
SCHEMBL7217660 0.73 CNR2 (0.81) CNR2CNR1
SCHEMBL7216957 0.73 CNR2 (0.69) CNR2CNR1HSP90AA1

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-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases BRISTOL-MYERS SQUIBB COMPANY 2002-08-29 US claimed
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 US disclosed
US-6653304-B2 Antiarthritic agents; skin disorders; anticarcinogenic agents BRISTOL-MYERS SQUIBB CO. 2003-11-25 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-20020119972-A1 Cannabinoid receptor modulators, their processes of preparation, and use of cannabinoid receptor modulators for treating respiratory and non-respiratory diseases CNR1, CNR2, GPR18 CNR2 2/4885CNR1 1/4885HSP90AA1 4085/4885

“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.