SCHEMBL15087793

SCHEMBL15087793

CCN(CC)c1ccc(CCC(NC(=O)Cc2ccccc2)NC(=O)Cc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.72
KMT2A Q03164 2/20 0.67
MEN1 O00255 1/20 0.67
AOC3 Q16853 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ALDH1A1 P00352 4/20 0.54
POLB P06746 2/20 0.54
MAPT P10636 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HPGD P15428 1/20 0.51

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
SCHEMBL15064979 0.85 CNR2 (1.00) CNR2KMT2AMEN1ALDH1A1POLB
SCHEMBL9845802 0.76 MEN1 (0.67) CNR2KMT2AMEN1AOC3L3MBTL1
SCHEMBL9845804 0.76 ALDH1A1 (0.75) CNR2KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL5325778 0.75 KMT2A (0.76) CNR2KMT2AMEN1L3MBTL1NPSR1
SCHEMBL15087787 0.75 CNR2 (0.71) CNR2KMT2AMEN1AOC3L3MBTL1
SCHEMBL15064610 0.75 CNR2 (1.00) CNR2KMT2AMEN1ALDH1A1POLB
SCHEMBL15064314 0.74 CNR2 (1.00) CNR2KMT2AMEN1ALDH1A1POLB
SCHEMBL1432499 0.74 AOC3 (1.00) CNR2KMT2AMEN1AOC3L3MBTL1
SCHEMBL81937 0.73 CNR2 (0.71) CNR2KMT2AMEN1AOC3L3MBTL1
SCHEMBL6297588 0.73 ALDH1A1 (0.81) CNR2KMT2AMEN1ALDH1A1POLB

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-20170001949-A1 NOVEL CANNABINOID RECEPTOR 2 (CB2) INVERSE AGONISTS AND THERAPEUTIC POTENTIAL FOR MULTIPLE MYELOMA AND OSTEOPOROSIS BONE DISEASES UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-01-05 US disclosed
US-20130172388-A1 NOVEL CANNABINOID RECEPTOR 2 (CB2) INVERSE AGONISTS AND THERAPEUTIC POTENTIAL FOR MULTIPLE MYELOMA AND OSTEOPOROSIS BONE DISEASES UNIVERSITY OF PITTSBURGH -- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2013-07-04 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-20170001949-A1 NOVEL CANNABINOID RECEPTOR 2 (CB2) INVERSE AGONISTS AND THERAPEUTIC POTENTIAL FOR MULTIPLE MYELOMA AND OSTEOPOROSIS BONE DISEASES CNR2, CNR1, GPR3 CNR2 1/4885KMT2A 2167/4885MEN1 1834/4885
US-20130172388-A1 NOVEL CANNABINOID RECEPTOR 2 (CB2) INVERSE AGONISTS AND THERAPEUTIC POTENTIAL FOR MULTIPLE MYELOMA AND OSTEOPOROSIS BONE DISEASES CNR2, CNR1, GPR3 CNR2 1/4885KMT2A 2385/4885MEN1 2176/4885

“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.