SCHEMBL14731236

SCHEMBL14731236

COc1cc(C)cc2c1CCC(=O)N2C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 2/20 0.40
▸ CYP11B1 P15538 2/20 0.40
▸ CYP11B2 P19099 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ ACHE P22303 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ GAA P10253 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 3/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ SIGMAR1 Q99720 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL14726024 0.80 TRIM24 (0.38) TRIM24CYP11B1CYP11B2POLBCYP3A4
SCHEMBL18022948 0.80 PTGS2 (0.42) TRIM24CYP11B1CYP11B2KDM4ECYP3A4
SCHEMBL14438071 0.74 SRD5A1 (0.42) TRIM24CYP11B1CYP11B2POLBKDM4E
SCHEMBL12057333 0.72 CYP11B1 (0.52) TRIM24CYP11B1CYP11B2POLBCYP3A4
SCHEMBL422356 0.72 PDE3B (0.50) POLBKDM4ECYP3A4ACHECYP1A2
SCHEMBL4036037 0.69 ALDH1A1 (0.50) KDM4EACHEGAASMN1; SMN2MAPT
SCHEMBL14438069 0.68 KDM4E (0.41) TRIM24CYP11B1CYP11B2POLBKDM4E
SCHEMBL14330058 0.67 ACHE (0.48) KDM4ECYP3A4ACHEGAASMN1; SMN2
SCHEMBL885034 0.67 NOTUM (0.49) MAPTSIGMAR1
SCHEMBL6074490 0.67 CYP11B1 (0.50) TRIM24CYP11B1CYP11B2POLBCYP3A4

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-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 — — US disclosed
EP-3056207-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE Otsuka Pharmaceutical Co., Ltd. (JP) 2016-08-17 — — EP disclosed
US-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORPORATION 2015-10-29 — — US disclosed
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 — — 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 (3 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-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA TRIM24 3851/4885CYP11B1 3532/4885CYP11B2 3580/4885
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PPP3CB, PTPRG TRIM24 3738/4885CYP11B1 3667/4885CYP11B2 3834/4885
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA TRIM24 3851/4885CYP11B1 3532/4885CYP11B2 3580/4885

“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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