SCHEMBL14130362

SCHEMBL14130362

C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2CN1C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 3/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.38
AVPR2 P30518 3/20 0.38
GAA P10253 1/20 0.38
WDR5 P61964 1/20 0.37
RECQL P46063 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC6A9 P48067 1/20 0.36
SLC6A5 Q9Y345 1/20 0.36
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL8267303 0.89 MAPT (0.42) MAPTKMT2AMEN1LMNANPC1
SCHEMBL2951982 0.89 MAPT (0.42) MAPTKMT2AMEN1LMNANPC1
SCHEMBL5066806 0.87 MAPT (0.45) MAPTKMT2AMEN1LMNANPC1
SCHEMBL14130169 0.87 AVPR2 (0.41) KMT2AMEN1AVPR2
SCHEMBL14130019 0.86 AVPR2 (0.42) KMT2AMEN1LMNASMN1; SMN2AVPR2
SCHEMBL14130356 0.86 AVPR2 (0.45) AVPR2
SCHEMBL14130355 0.85 LMNA (0.40) MAPTKMT2AMEN1LMNAHTT
SCHEMBL14130017 0.85 AVPR2 (0.43) AVPR2
SCHEMBL14130405 0.83 AVPR2 (0.39) KMT2AMEN1LMNAALDH1A1HPGD
SCHEMBL14130136 0.83 NPC1 (0.39) KMT2AMEN1NPC1AVPR2

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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these AVPR2, UTS2R, GPR119 MAPT 4383/4885KMT2A 3949/4885MEN1 1124/4885

“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.