SCHEMBL14098640

SCHEMBL14098640

O=C(Nc1ccccc1)Nc1cccc(S(=O)(=O)CCCO)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 4/20 0.64
▸ CA12 O43570 7/20 0.61
▸ CA1 P00915 7/20 0.61
▸ CA2 P00918 7/20 0.61
▸ CA9 Q16790 7/20 0.61
▸ MAPT P10636 4/20 0.61
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ TP53 P04637 1/20 0.47
▸ EPHX1 P07099 1/20 0.47
▸ TSHR P16473 1/20 0.47

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
SCHEMBL14098642 0.82 EPHX2 (0.57) EPHX2CA12CA1CA2CA9
SCHEMBL4007376 0.79 EPHX2 (1.00) EPHX2CYP2C19MEN1KMT2ALMNA
SCHEMBL6295746 0.78 CA12 (0.69) EPHX2CA12CA1CA2CA9
SCHEMBL14098638 0.78 EPHX2 (0.55) EPHX2CA12CA1CA2CA9
SCHEMBL7458282 0.78 CA12 (0.61) EPHX2CA12CA1CA2CA9
SCHEMBL26382140 0.77 CA12 (0.73) EPHX2CA12CA1CA2CA9
SCHEMBL7207184 0.77 CA2 (0.66) CA2MAPTCYP2C9CYP2C19
SCHEMBL1395590 0.76 CA1 (1.00) CA12CA1CA2CA9MAPT
SCHEMBL11897191 0.75 MAPT (0.69) CA12CA1CA2CA9MAPT
SCHEMBL19501797 0.74 HDAC1 (0.60) EPHX2MAPTCYP1A2CYP2D6MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 — — US disclosed
US-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-28 — — US disclosed
WO-2008039999-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-04-03 — — WO 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-20080207622-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 EPHX2 2/4885CA12 2404/4885CA1 1212/4885

“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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