SCHEMBL7223448

SCHEMBL7223448

COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccn(CCN2CCOCC2)c1C

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.65
CNR1 P21554 3/20 0.60
TACR2 P21452 2/20 0.51
CAPN1 P07384 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 1/20 0.48
GFER P55789 1/20 0.48
GAA P10253 1/20 0.45
TRPV4 Q9HBA0 1/20 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
SCHEMBL7218603 0.86 CNR2 (0.61) CNR2CNR1TACR2CAPN1TRPV4
SCHEMBL7217580 0.84 CNR2 (0.69) CNR2CNR1TACR2CYP3A4CYP2D6
SCHEMBL7216889 0.81 CNR2 (0.66) CNR2CNR1TACR2CYP3A4CYP2D6
SCHEMBL7218747 0.80 CNR2 (0.47) CNR2CNR1TACR2CAPN1TRPV4
SCHEMBL7217660 0.79 CNR2 (0.81) CNR2CNR1
SCHEMBL7224460 0.79 CNR2 (1.00) CNR2CNR1
SCHEMBL7216928 0.77 CNR2 (0.84) CNR2CNR1
SCHEMBL7222216 0.76 CNR2 (0.59) CNR2CNR1TACR2CYP3A4CYP2D6
SCHEMBL7217492 0.75 CNR2 (1.00) CNR2CNR1
SCHEMBL7223450 0.75 CNR2 (1.00) CNR2CNR1

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-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-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 1/4885TACR2 431/4885

“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.