SCHEMBL10265374

SCHEMBL10265374

CCc1nc(CC(=O)N2CCC(N)C2)c(C(=O)O)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.38
MAOA P21397 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
POLB P06746 1/20 0.33
PIK3CD O00329 6/20 0.33
PIK3CB P42338 6/20 0.33
CYP3A4 P08684 3/20 0.33
DPP4 P27487 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
IKBKB O14920 2/20 0.32
MCHR1 Q99705 1/20 0.32
PIK3CG P48736 2/20 0.32
PIK3CA P42336 1/20 0.32
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL13494112 0.86 L3MBTL1 (0.46) KDM1AMAOAL3MBTL1ALDH1A1LMNA
SCHEMBL5556178 0.84 L3MBTL1 (0.39) L3MBTL1ALDH1A1LMNARAB9APIK3CD
SCHEMBL5525943 0.83 L3MBTL1 (0.36) KDM1AMAOAL3MBTL1ALDH1A1LMNA
SCHEMBL5558508 0.81 SMN1; SMN2 (0.40) L3MBTL1ALDH1A1PIK3CDPIK3CBCYP3A4
SCHEMBL5552970 0.80 SMN1; SMN2 (0.45) L3MBTL1ALDH1A1PIK3CDPIK3CBGAA
SCHEMBL5551871 0.79 MAPT (0.40) KDM1AL3MBTL1ALDH1A1LMNARAB9A
SCHEMBL10266176 0.78 PIK3CD (0.43) POLBPIK3CDPIK3CBCYP3A4PIK3CG
SCHEMBL13494128 0.78 L3MBTL1 (0.47) L3MBTL1ALDH1A1LMNAPIK3CDPIK3CB
SCHEMBL5525930 0.75 DPP4 (0.38) L3MBTL1ALDH1A1PIK3CDPIK3CBCYP3A4
SCHEMBL5556851 0.74 DTYMK (0.38) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2012-05-03 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-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS POLI, POLB, POLA1 KDM1A 1087/4885MAOA 811/4885L3MBTL1 4872/4885

“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.