SCHEMBL10253269

SCHEMBL10253269

O=C(Nc1ccc(C(F)(F)F)cc1)N1CCCN(C(=O)C2CCC(F)(F)CC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 5/20 0.64
▸ MAPT P10636 1/20 0.56
▸ CNR1 P21554 1/20 0.55
▸ EPHX2 P34913 4/20 0.55
▸ KDM4E B2RXH2 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ TRPV1 Q8NER1 5/20 0.50
▸ CCR2 P41597 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL10253447 0.89 CNR2 (0.78) CNR2MAPTCNR1EPHX2KDM4E
SCHEMBL10253332 0.85 CNR2 (0.80) CNR2MAPTCNR1EPHX2KDM4E
SCHEMBL4559682 0.82 MAPT (0.73) CNR2MAPTCNR1EPHX2KDM4E
SCHEMBL14934356 0.79 EPHX2 (0.76) CNR2EPHX2
SCHEMBL14306236 0.79 MAPT (0.69) CNR2MAPTCNR1EPHX2TRPV1
SCHEMBL10253368 0.78 CNR2 (1.00) CNR2MAPTCNR1PKMTRPV1
SCHEMBL6153200 0.78 KMT2A (0.69) CNR2MAPTCNR1EPHX2TRPV1
SCHEMBL10253649 0.77 CNR2 (0.84) CNR2MAPTCNR1EPHX2
SCHEMBL10253343 0.77 CNR2 (1.00) CNR2MAPTCNR1EPHX2PKM
SCHEMBL14934436 0.76 EPHX2 (0.76) EPHX2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173638-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-08 — — US disclosed
US-8173638-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-08 — — US disclosed
US-20100009964-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-14 — — US disclosed
US-20100009964-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-14 — — US disclosed
WO-2008064054-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-05-29 — — WO 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-20100009964-A1 Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 CNR2 1/4885MAPT 3811/4885CNR1 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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