SCHEMBL2268145

SCHEMBL2268145

NC[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
HPGD P15428 1/20 0.45
CYP1A2 P05177 1/20 0.44
MMP2 P08253 2/20 0.44
SRR Q9GZT4 2/20 0.42
SLC1A3 P43003 2/20 0.42
SLC1A2 P43004 2/20 0.42
SLC1A1 P43005 2/20 0.42
EPHX1 P07099 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL18341181 0.86 KMT2A (0.47) MEN1KMT2AALPIPKMPTGS1
SCHEMBL18341183 0.86 KMT2A (0.47) MEN1KMT2AALPIPKMPTGS1
SCHEMBL1024207 0.86 KMT2A (0.47) MEN1KMT2AALPIPKMPTGS1
Hydrochloric Acid SCHEMBL20974172 0.85 KMT2A (0.46) MEN1KMT2AALPIPKMPTGS1
Hydrochloric Acid SCHEMBL20974171 0.85 KMT2A (0.46) MEN1KMT2AALPIPKMPTGS1
Hydrochloric Acid SCHEMBL4856193 0.85 KMT2A (0.46) MEN1KMT2AALPIPKMPTGS1
SCHEMBL9012916 0.84 MEN1 (0.49) MEN1KMT2AALPIPKMPTGS1
SCHEMBL17101835 0.81 ALDH1A1 (0.43) MEN1KMT2AALDH1A1LMNAPOLB
SCHEMBL18783553 0.81 MEN1 (0.43) MEN1KMT2ACYP1A2ALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL16445701 0.81 CES1 (0.41) MEN1KMT2AALPIPKMPTGS1

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
WO-2011104649-A1 PEPTIDE ANALOGUES PFIZER LIMITED (GB) 2011-09-01 WO disclosed
US-20110207654-A1 PEPTIDE ANALOGUES PFIZER INC. 2011-08-25 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-20110207654-A1 PEPTIDE ANALOGUES OPRL1, OGFR, OPRM1 MEN1 2911/4885KMT2A 4549/4885ALPI 3087/4885

“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.