SCHEMBL4558359

SCHEMBL4558359

Cc1cccnc1-c1ccc(C(=O)O)nc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.60
CYP2A6 P11509 1/20 0.56
CNR2 P34972 1/20 0.50
P4HTM Q9NXG6 2/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NAPRT Q6XQN6 1/20 0.46
KDM4E B2RXH2 4/20 0.44
P4HA1 P13674 1/20 0.44
MIF P14174 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ABL1 P00519 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PTGS2 P35354 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL28255301 0.85 P4HTM (0.47) TRPV1P4HTMLMNAL3MBTL1NAPRT
SCHEMBL4182641 0.83 CNR2 (0.49) TRPV1CNR2P4HTMLMNAL3MBTL1
SCHEMBL31426284 0.82 TRPV1 (0.46) TRPV1P4HTMLMNAL3MBTL1NAPRT
SCHEMBL3554044 0.80 TRPV1 (0.61) TRPV1CYP2A6KDM4ETDP1MAPK1
SCHEMBL16114340 0.79 CYP2A6 (0.67) TRPV1CYP2A6CNR2ABL1
SCHEMBL4174480 0.79 TRPV1 (0.54) TRPV1
Hydrochloric Acid SCHEMBL3086577 0.79 TRPV1 (0.59) TRPV1CYP2A6KDM4ETDP1MAPK1
SCHEMBL8292446 0.77 TRPV1 (0.81) TRPV1
SCHEMBL13731115 0.76 P4HTM (0.64) P4HTMLMNAL3MBTL1NAPRTKDM4E
SCHEMBL12817334 0.76 CYP2A6 (0.62) TRPV1CYP2A6CNR2ABL1

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-7504412-B2 Imidazopyridine derivatives BANYU PHARMACEUTICALS, CO., LTD. (JP) 2009-03-17 US disclosed
US-20080200494-A1 Imidazopyridine Derivatives MSD K.K. (JP) 2008-08-21 US disclosed
EP-1657242-A1 IMIDAZOPYRIDINE DERIVATIVES Banyu Pharmaceutical Co., Ltd. (JP) 2006-05-17 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-20080200494-A1 Imidazopyridine Derivatives MC1R, MC3R, MC5R TRPV1 183/4885CYP2A6 341/4885CNR2 177/4885

“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.