SCHEMBL10270125

SCHEMBL10270125

CCOC(=O)[C@H]1CC[C@@H](C(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PPM1B O75688 1/20 0.42
PTPN1 P18031 1/20 0.42
PPP1CC P36873 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
LIPE Q05469 1/20 0.41

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
SCHEMBL12303975 1.00 MAPT (0.51) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL824135 1.00 MAPT (0.51) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL824180 0.89 MAPT (0.45) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL17716490 0.87 SOAT1 (0.47) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL2375356 0.85 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL4221 0.85
SCHEMBL8891623 0.85 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL237380 0.85 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL24370556 0.85 PPM1B (0.45) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL11189385 0.85 MAPT (0.49) MAPTALDH1A1MEN1KMT2APPM1B

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
WO-2012018668-A1 BENZIMIDAZOLE AND AZABENZIMIDAZOLE COMPOUNDS THAT INHIBIT ANAPLASTIC LYMPHOMA KINASE AMGEN INC. (US) 2012-02-09 WO disclosed
US-20110230465-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2011-09-22 US disclosed
US-20110230465-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2011-09-22 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-20110230465-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E MAPT 3171/4885ALDH1A1 1625/4885MEN1 4804/4885

“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.