SCHEMBL2894048

SCHEMBL2894048

Cc1c(N2CCN(C(=O)NC(C)(C)C)CC2=O)nnn1-c1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.44
P2RX7 Q99572 9/20 0.42
CSNK1E P49674 5/20 0.40
CNR1 P21554 3/20 0.39
CNR2 P34972 2/20 0.39
CSNK1D P48730 2/20 0.39
GAA P10253 1/20 0.37

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
SCHEMBL2887702 0.86 CSNK1E (0.45) CSNK1ECSNK1DGAA
SCHEMBL2891520 0.86 P2RX7 (0.46) RBP4P2RX7
SCHEMBL2889100 0.85 MEN1 (0.45) RBP4P2RX7
SCHEMBL2889480 0.81 P2RX7 (0.42) RBP4P2RX7
SCHEMBL2894092 0.74 MEN1 (0.45) P2RX7GAA
SCHEMBL5481400 0.73 P2RX7 (0.37) P2RX7
SCHEMBL2889747 0.73 SCN9A (0.49)
SCHEMBL12975581 0.73 POLB (0.49) P2RX7CNR1CNR2
SCHEMBL2889963 0.72 ADRB1 (0.40)
SCHEMBL5483719 0.71 HTT (0.47) P2RX7GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858800-B2 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-28 US disclosed
US-7858800-B2 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-28 US disclosed
US-7858800-B2 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-12-28 US disclosed
US-20070191389-A1 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
US-20070191389-A1 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
US-20070191389-A1 Biaryl derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
EP-1764362-A1 BIARYL DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-03-21 EP 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-20070191389-A1 Biaryl derivatives GRM1, GRIN1, GRIN2B RBP4 4190/4885P2RX7 1337/4885CSNK1E 602/4885

“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.