SCHEMBL13701644

SCHEMBL13701644

CC(C)(C)NC(=O)c1cccc(-c2ccccc2O)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 9/20 0.52
▸ KDM1A O60341 1/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ PTPN5 P54829 1/20 0.47
▸ LMNA P02545 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HSD17B14 Q9BPX1 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ S100B P04271 1/20 0.43
▸ KISS1R Q969F8 1/20 0.43

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
SCHEMBL13611931 0.85 NR1H4 (0.60) ANO1LMNANR1H4HDAC8MEN1
SCHEMBL13701695 0.83 HDAC8 (0.64) ANO1LMNANR1H4HDAC8MAPT
SCHEMBL13701684 0.82 BCAT2 (0.51) ANO1LMNANR1H4HDAC8MEN1
SCHEMBL13611927 0.81 S100B (0.47) ANO1MEN1KMT2AMAPTS100B
SCHEMBL13701677 0.80 KDM4E (0.50) ANO1LMNAHDAC8MEN1KMT2A
SCHEMBL13701634 0.79 MEN1 (0.58) ANO1LMNAHDAC8MEN1KMT2A
SCHEMBL21249304 0.79 LMNA (0.58) ANO1HDAC6LMNAHDAC8KMT2A
SCHEMBL13701631 0.78 HDAC8 (0.54) HDAC6LMNAHDAC8KMT2A
SCHEMBL13701654 0.78 RXRA (0.59) LMNANR1H4HDAC8MEN1KMT2A
SCHEMBL24454658 0.78 ALDH1A1 (0.50) KDM1AHDAC1HDAC6PTPN5HSD17B14

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 ANO1 4532/4885KDM1A 1849/4885HDAC1 1438/4885

“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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