SCHEMBL9891491

SCHEMBL9891491

COCC(C)(C)c1cc(C(C)(C)C)on1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.39
CNR2 P34972 5/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
EGFR P00533 2/20 0.37
HPGD P15428 1/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
RAF1 P04049 1/20 0.33
POLB P06746 1/20 0.33
EPHX2 P34913 2/20 0.31
MAPK14 Q16539 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL9891486 0.86 ALDH1A1 (0.35) CNR1CNR2MEN1KMT2AEGFR
SCHEMBL14724233 0.80 CNR1 (0.40) CNR1CNR2EGFRNPC1RAB9A
SCHEMBL19480613 0.79 MEN1 (0.46) CNR1CNR2MEN1KMT2AEGFR
SCHEMBL1012596 0.79 CNR2 (0.39) CNR1CNR2MAPK14
SCHEMBL9891487 0.78 EGFR (0.42) CNR1CNR2MEN1KMT2AEGFR
SCHEMBL14723926 0.77 CNR1 (0.41) CNR1CNR2MEN1KMT2AHPGD
SCHEMBL9892809 0.77 CNR1 (0.39) CNR1CNR2MAPK14
SCHEMBL22560698 0.76 MEN1 (0.40) CNR1CNR2MEN1KMT2AEGFR
SCHEMBL84872 0.76 MEN1 (0.48) CNR1CNR2MEN1KMT2AEGFR
SCHEMBL25803019 0.74 MEN1 (0.38) MEN1KMT2AEGFRHPGDNPC1

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-8383615-B2 Azetidine 2-carboxamide derivatives which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-02-26 US disclosed
US-20120142666-A1 Azetidine 2-Carboxamide Derivatives Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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-20120142666-A1 Azetidine 2-Carboxamide Derivatives Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 CNR1 2/4885CNR2 1/4885MEN1 4667/4885

“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.