SCHEMBL13611592

SCHEMBL13611592

C=C1OB(c2ccc(CCNS(=O)(=O)c3ccccc3F)cc2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
GRIA4 P48058 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
NSD2 O96028 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GBA1 P04062 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL13612192 0.88 CA1 (0.40) ALDH1A1MEN1KMT2ANSD2HTT
SCHEMBL13611591 0.85 SMN1; SMN2 (0.35) ALDH1A1KMT2ANSD2HTTNPSR1
SCHEMBL13612184 0.85 ALDH1A1 (0.49) TAAR1ALDH1A1MEN1KMT2AMAPT
SCHEMBL13604122 0.85 LPL (0.47) TP53GRIA4TAAR1TSHRALDH1A1
SCHEMBL8288351 0.84 TP53 (0.42) TP53GRIA4TAAR1TSHRALDH1A1
SCHEMBL13612187 0.82 ALDH1A1 (0.42) TAAR1ALDH1A1KMT2A
SCHEMBL13611590 0.76 ALDH1A1 (0.40) ALDH1A1MEN1KMT2A
SCHEMBL10282788 0.73 LPL (0.40) CA1CA2CA9
SCHEMBL13604132 0.72 LPL (0.47) ALDH1A1KMT2ANSD2HTTNPSR1
SCHEMBL8288313 0.70 CA1 (0.42) ALDH1A1KMT2ANSD2HTTNPSR1

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
US-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 US disclosed
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY 2007-03-22 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-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors GRIN1, GRIN3A, GRIK5 TP53 1303/4885GRIA4 16/4885TAAR1 373/4885

“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.