SCHEMBL2885844

SCHEMBL2885844

Cc1c(N2CCN(C(=O)O)CC2)nnn1-c1cccnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.41
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HSD11B1 P28845 1/20 0.38
AVPR1A P37288 2/20 0.38
TRPA1 O75762 3/20 0.38
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
GAA P10253 1/20 0.38
KCNH2 Q12809 1/20 0.37
TRPM8 Q7Z2W7 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
SCHEMBL2888999 0.85 GRM5 (0.50) TRPV1LMNAMAPTTRPA1FAAH
SCHEMBL12975589 0.85 POLB (0.56) TRPV1MAPTTRPA1
SCHEMBL5481400 0.84 P2RX7 (0.37) HSD11B1
SCHEMBL2335427 0.80 GAA (0.47) LMNAMAPTHSD11B1GAA
SCHEMBL2890817 0.78 HTT (0.52) LMNAMAPTFAAHMGLL
SCHEMBL2890753 0.75 GRM1 (0.61) TRPV1
SCHEMBL12975581 0.73 POLB (0.49) LMNAMAPT
SCHEMBL5693374 0.72 TRPA1 (0.64) TRPV1TRPA1KCNH2TRPM8
SCHEMBL20339483 0.72 TRPV1 (0.61) TRPV1HSD11B1AVPR1AGAA
SCHEMBL12530264 0.72 GRM1 (0.39) LMNAMAPT

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 3 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-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 TRPV1 236/4885LMNA 3873/4885MAPT 1892/4885

“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.