SCHEMBL10224231

SCHEMBL10224231

COCCCOc1cccc(C(C)C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.60
▸ TSHR P16473 1/20 0.60
▸ ALDH1A1 P00352 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ PTGES O14684 1/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ PPARG P37231 1/20 0.49
▸ PPARA Q07869 1/20 0.49
▸ ACACB O00763 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
SCHEMBL10224193 0.91 KDM4E (0.62) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL24233057 0.87 KDM4E (0.57) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL12652785 0.84 KDM4E (0.67) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL20647155 0.83 KDM4E (0.60) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL17905720 0.83 KDM4E (0.65) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL13251244 0.83 KDM4E (0.60) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL3151292 0.82 KDM4E (0.55) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL5018851 0.82 KDM4E (0.69) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL9978459 0.82 CYP1A2 (0.47) KDM4ETSHRALDH1A1LMNASMN1; SMN2
SCHEMBL20225797 0.81 TSHR (0.63) KDM4ETSHRALDH1A1LMNASMN1; SMN2

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-8148367-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-03 — — US disclosed
US-20100105665-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-04-29 — — 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-20100105665-A1 RENIN INHIBITORS REN, ACE, AGT KDM4E 2733/4885TSHR 2563/4885ALDH1A1 947/4885

“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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