SCHEMBL1336080

SCHEMBL1336080

C[C@@H](c1ccccc1)N(Cc1ccncc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.52
CYP2C19 P33261 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP3A4 P08684 3/20 0.52
LMNA P02545 2/20 0.52
CHRM1 P11229 2/20 0.52
CYP1A2 P05177 2/20 0.52
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52
CHRM5 P08912 1/20 0.52
MAPT P10636 1/20 0.52
CHRM3 P20309 1/20 0.52
BLM P54132 1/20 0.52
TSHR P16473 1/20 0.52
NFKB1 P19838 1/20 0.52
HSD17B10 Q99714 1/20 0.52
FNTA P49354 6/20 0.47
FNTB P49356 6/20 0.47
GAA P10253 1/20 0.46

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
Hydrochloric Acid SCHEMBL1666230 0.98 MEN1 (0.51) CYP2C9CYP2C19MEN1KMT2ACYP3A4
SCHEMBL25212194 0.85 LMNA (0.55) MEN1KMT2ALMNAFNTAFNTB
SCHEMBL25203986 0.85 LMNA (0.55) MEN1KMT2ALMNAFNTAFNTB
SCHEMBL25212195 0.85 LMNA (0.55) MEN1KMT2ALMNAFNTAFNTB
SCHEMBL1335409 0.80 CYP2C9 (0.54) CYP2C9CYP2C19MEN1KMT2ACYP3A4
SCHEMBL18711384 0.79 MEN1 (0.56) MEN1KMT2ALMNAHSD17B10ALDH1A1
SCHEMBL18711381 0.79 MEN1 (0.56) MEN1KMT2ALMNAHSD17B10ALDH1A1
SCHEMBL531674 0.78 MEN1 (0.48) CYP2C9CYP2C19MEN1KMT2ACYP3A4
SCHEMBL531673 0.78 MEN1 (0.48) CYP2C9CYP2C19MEN1KMT2ACYP3A4
SCHEMBL18711382 0.78 MEN1 (0.54) MEN1KMT2ALMNAHSD17B10ALDH1A1

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-20110275678-A1 New Pyridine Derivatives as Leptin Receptor Modulator Mimetics BIOVITRUM AB (SE) 2011-11-10 US claimed
US-20110275678-A1 New Pyridine Derivatives as Leptin Receptor Modulator Mimetics BIOVITRUM AB (SE) 2011-11-10 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-20110275678-A1 New Pyridine Derivatives as Leptin Receptor Modulator Mimetics GPR119, GLP1R, ADIPOR1 CYP2C9 3272/4885CYP2C19 2456/4885MEN1 2744/4885

“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.