SCHEMBL16467940

SCHEMBL16467940

CC(C)(C)C(CCN(Cc1cccc(N)c1)C(=O)O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASR P41180 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 5/20 0.39
MAPT P10636 4/20 0.39
OPRK1 P41145 1/20 0.39
POLB P06746 2/20 0.39
RECQL P46063 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PTGES O14684 4/20 0.39
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL16468157 0.90 MEN1 (0.53) CASRMEN1KMT2AALDH1A1MAPT
SCHEMBL16467944 0.90 MEN1 (0.42) CASRMEN1KMT2AALDH1A1LMNA
SCHEMBL16467951 0.88 OPRK1 (0.40) CASRMEN1KMT2AOPRK1RECQL
SCHEMBL16467914 0.82 ALDH1A1 (0.52) CASRMEN1KMT2AALDH1A1OPRK1
SCHEMBL16468155 0.80 PTGES (0.38) KMT2AALDH1A1OPRK1PTGESNPC1
SCHEMBL16468270 0.80 OPRK1 (0.39) OPRK1PTGESLMNAHSD11B1KDM4E
SCHEMBL16468258 0.79 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL16468455 0.79 PTGES (0.41) OPRK1RECQLPTGESLMNAPKM
SCHEMBL15265423 0.79 MAOA (0.53) L3MBTL1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL16468252 0.78 PTGES (0.44) MEN1KMT2AL3MBTL1PTGESPKM

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-20150051257-A1 SULPHONAMIDE DERIVATIVES OF BENZYLAMINE FOR THE TREATMENT OF CNS DISEASES ADAMED SP. ZO.O (PL) 2015-02-19 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-20150051257-A1 SULPHONAMIDE DERIVATIVES OF BENZYLAMINE FOR THE TREATMENT OF CNS DISEASES AQP4, BCL6, STS CASR 3812/4885MEN1 2136/4885KMT2A 896/4885

“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.