SCHEMBL660987

SCHEMBL660987

CCOC(=O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(I)s2)c1C

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.64
CNR2 P34972 16/20 0.64
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
MAPT P10636 1/20 0.57
MAPK1 P28482 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL1984928 0.91 CNR1 (0.65) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL3279584 0.89 CNR2 (0.65) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL8393429 0.87 KDM4E (0.55) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL3294629 0.87 CNR1 (0.57) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL3294625 0.87 CNR1 (0.57) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL4972174 0.86 CNR2 (0.69) CNR1CNR2
SCHEMBL8399401 0.85 CNR1 (0.56) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL3280613 0.84 CNR2 (0.64) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL3280901 0.84 CNR1 (0.68) CNR1CNR2
SCHEMBL3279928 0.84 CNR1 (0.71) CNR1CNR2

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-8853205-B2 Heteropyrrole analogs acting on cannabinoid receptors UNIVERSITY OF CONNECTICUT (US) 2014-10-07 US disclosed
US-20120046280-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS UNIVERSITY OF CONNECTICUT 2012-02-23 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-20120046280-A1 NOVEL HETEROPYRROLE ANALOGS ACTING ON CANNABINOID RECEPTORS CNR1, CNR2, CBR3 CNR1 1/4885CNR2 2/4885KDM4E 3786/4885

“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.