SCHEMBL7604791

SCHEMBL7604791

O=C(O)C1C[C@@H](C(=O)O)CN1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.46
FABP7 O15540 2/20 0.46
KMT2A Q03164 2/20 0.41
EPHX2 P34913 1/20 0.39
S1PR1 P21453 1/20 0.37
S1PR5 Q9H228 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
OPRD1 P41143 1/20 0.37
MDM4 O15151 1/20 0.36
TP53 P04637 1/20 0.36
AGTR2 P50052 1/20 0.36
CASP3 P42574 2/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16838567 1.00 FABP5 (0.46) FABP5FABP7KMT2AEPHX2S1PR1
SCHEMBL7606819 1.00 FABP5 (0.46) FABP5FABP7KMT2AEPHX2S1PR1
SCHEMBL16838566 1.00 FABP5 (0.46) FABP5FABP7KMT2AEPHX2S1PR1
SCHEMBL8127912 0.89 FABP5 (0.46) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL8121431 0.88 FABP5 (0.45) FABP5FABP7KMT2AEPHX2OPRD1
SCHEMBL1334889 0.88 FABP5 (0.46) FABP5FABP7KMT2AEPHX2
SCHEMBL4612189 0.88 FABP5 (0.46) FABP5FABP7KMT2AEPHX2
SCHEMBL16153163 0.88 FABP5 (0.46) FABP5FABP7KMT2AEPHX2CA1
SCHEMBL1000852 0.88 FABP5 (0.46) FABP5FABP7KMT2AEPHX2
SCHEMBL1336708 0.88 FABP5 (0.46) FABP5FABP7KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120122803-A1 ALPHA-CONOTOXIN MII ANALOGS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-05-17 US disclosed
US-8101573-B2 α-conotoxin MII analogs UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-01-24 US disclosed
US-20110064668-A1 J-SUPERFAMILY CONOTOXIN PEPTIDES UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2011-03-17 US disclosed
US-20090005316-A1 ALPHA-CONOTOXIN MII ANALOGS UNIVERSITY OF UTAH (US) 2009-01-01 US disclosed
US-7387997-B2 α-conotoxin MII analogues UNIVERSITY OF UTAH (US) 2008-06-17 US disclosed
US-20080089844-A1 Kappam-conopeptides as organ protectants OLIVERA BALDOMERO M 2008-04-17 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 (4 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-20120122803-A1 ALPHA-CONOTOXIN MII ANALOGS CHRNA6, CHRNG, CHRNA1 FABP5 2135/4885FABP7 1414/4885KMT2A 2782/4885
US-20090005316-A1 ALPHA-CONOTOXIN MII ANALOGS CHRNA6, CHRNG, CHRNA1 FABP5 2135/4885FABP7 1414/4885KMT2A 2782/4885
US-20110064668-A1 J-SUPERFAMILY CONOTOXIN PEPTIDES KCNQ1, KCNQ2, KCNA3 FABP5 1647/4885FABP7 791/4885KMT2A 2701/4885
US-20080089844-A1 Kappam-conopeptides as organ protectants VIP, KLK1, KLKB1 FABP5 2530/4885FABP7 490/4885KMT2A 2349/4885

“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.