SCHEMBL13701672

SCHEMBL13701672

CC(C)(C)NC(=O)c1cccc(-c2cccc(C(N)=O)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.48
▸ PLAT P00750 1/20 0.48
▸ LMNA P02545 2/20 0.48
▸ HDAC8 Q9BY41 1/20 0.47
▸ PARP1 P09874 1/20 0.47
▸ CCNE2 O96020 1/20 0.47
▸ CCNE1 P24864 1/20 0.47
▸ CDK2 P24941 1/20 0.47
▸ FLT1 P17948 2/20 0.47
▸ CSF1R P07333 1/20 0.47
▸ FLT3 P36888 1/20 0.47
▸ ERN1 O75460 4/20 0.47
▸ CSNK1D P48730 1/20 0.46
▸ CSNK1E P49674 1/20 0.46
▸ S100B P04271 1/20 0.46
▸ DHODH Q02127 1/20 0.46
▸ CCNT1 O60563 1/20 0.46
▸ CCND1 P24385 1/20 0.46
▸ CCNC P24863 1/20 0.46
▸ CDK8 P49336 1/20 0.46

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
SCHEMBL13701638 0.92 PLAU (0.51) PLAUPLATLMNAHDAC8CCNE2
SCHEMBL3043951 0.92 PARP1 (0.52) LMNAPARP1S100BCYP2C19
SCHEMBL13701695 0.87 HDAC8 (0.64) LMNAHDAC8S100B
SCHEMBL13701631 0.85 HDAC8 (0.54) LMNAHDAC8CDK8CYP2C19
SCHEMBL13701654 0.85 RXRA (0.59) LMNAHDAC8S100BCYP2C19
SCHEMBL13701677 0.84 KDM4E (0.50) LMNAHDAC8CYP2C19
SCHEMBL13701684 0.83 BCAT2 (0.51) LMNAHDAC8S100B
SCHEMBL13701659 0.83 PLAU (0.56) PLAUPLATERN1CDK8
SCHEMBL13701634 0.83 MEN1 (0.58) LMNAHDAC8CYP2C19
SCHEMBL21249304 0.82 LMNA (0.58) LMNAHDAC8S100BCYP2C19

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-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 PLAU 592/4885PLAT 102/4885LMNA 1843/4885

“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.

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