SCHEMBL4875475

SCHEMBL4875475

O=C(Nc1ccc(-n2ccnc2)cc1)C(O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.52
CD38 P28907 2/20 0.51
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 3/20 0.48
HTT P42858 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PORCN Q9H237 3/20 0.46
TDP1 Q9NUW8 1/20 0.45
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
CYP26A1 O43174 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
CYP3A4 P08684 1/20 0.42

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
SCHEMBL3994163 0.84 EPHX2 (0.61) CD38KMT2AALDH1A1HTTLMNA
SCHEMBL4883098 0.79 CD38 (0.53) CD38KMT2AALDH1A1HTTLMNA
SCHEMBL709619 0.78 LMNA (0.58) CD38KMT2AALDH1A1HTTLMNA
SCHEMBL31202655 0.76 SMN1; SMN2 (0.53) KMT2AALDH1A1HTTMAPTPSEN1
SCHEMBL3095661 0.76 EPHX2 (0.51) KMT2AALDH1A1PSEN1PSEN2APH1B
SCHEMBL29521458 0.76 RAB9A (0.59) ACP1KMT2AALDH1A1HTTMAPT
SCHEMBL31202580 0.76 RAB9A (0.55) ACP1KMT2AALDH1A1HTTLMNA
SCHEMBL23053217 0.74 ADH5 (0.56) ACP1KMT2AHTTLMNAMAPT
SCHEMBL6794124 0.73 ALDH1A1 (0.53) CD38ALDH1A1LMNAMAPTPORCN
SCHEMBL3994281 0.73 EPHX2 (0.57) CD38KMT2AHTTMAPTEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
US-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-08-21 US disclosed
WO-2008073623-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-06-19 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-20080200467-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 ACP1 1260/4885CD38 3432/4885KMT2A 2022/4885

“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.