SCHEMBL13701720

SCHEMBL13701720

CCCOc1cccc(C(=O)NC(C)(C)C)c1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.67
KMT2A Q03164 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.62
MAPT P10636 2/20 0.62
NR1H4 Q96RI1 1/20 0.61
SMPD1 P17405 3/20 0.59
ALDH1A1 P00352 3/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
KAT6A Q92794 2/20 0.57
TSHR P16473 2/20 0.57
MAPK1 P28482 1/20 0.57
THRB P10828 1/20 0.54
MEN1 O00255 2/20 0.54
USP2 O75604 1/20 0.54
GAA P10253 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL13701712 0.93 LMNA (0.65) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL12133228 0.88 LMNA (0.82) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL13701726 0.84 LMNA (0.58) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL11213011 0.84 KMT2A (0.69) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL13702374 0.84 KMT2A (0.69) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL19079018 0.82 PLK1 (0.69) LMNAKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL13702136 0.81 KMT2A (0.66) LMNAKMT2ASMN1; SMN2MAPTNR1H4
SCHEMBL13701708 0.81 ESR1 (0.58) LMNASMN1; SMN2ALDH1A1GAANPSR1
SCHEMBL13701702 0.81 LMNA (0.55) LMNAKMT2ASMPD1ALDH1A1TSHR
SCHEMBL13701690 0.81 SMPD1 (0.71) LMNAKMT2ANR1H4SMPD1ALDH1A1

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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 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-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors EPHX1, EPHX2, EPX LMNA 1843/4885KMT2A 3792/4885SMN1; SMN2 4398/4885

“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.