SCHEMBL3269563

SCHEMBL3269563

CC(=O)N1CCc2c1cc(C)c(N)c2C

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 17/20 0.53
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CYP11B1 P15538 1/20 0.38
▸ CYP11B2 P19099 1/20 0.38

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
SCHEMBL3267361 0.81 NOTUM (0.53) NOTUMKDM4EALDH1A1HPGDCYP11B1
SCHEMBL27497129 0.79 NOTUM (0.50) NOTUMKDM4EALDH1A1HPGDCYP11B1
SCHEMBL5881634 0.77 NOTUM (0.48) NOTUMKDM4EALDH1A1HPGD
SCHEMBL1761252 0.77 NOTUM (0.48) NOTUMKDM4EALDH1A1HPGD
SCHEMBL5881552 0.76 NOTUM (0.47) NOTUMKDM4EALDH1A1HPGDCYP11B1
SCHEMBL1761149 0.76 NOTUM (0.61) NOTUMKDM4EALDH1A1HPGDCYP11B1
SCHEMBL5881609 0.74 NOTUM (0.45) NOTUMKDM4EALDH1A1HPGD
SCHEMBL6644014 0.73 EIF2AK3 (0.47) KDM4EALDH1A1
SCHEMBL5881721 0.73 NOTUM (0.44) NOTUMKDM4EALDH1A1HPGD
SCHEMBL3269518 0.71 NOTUM (0.41) NOTUMCYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1541553-B1 INDOLINE COMPOUND AND MEDICINAL USE THEREOF KYOTO PHARMA IND (JP) 2010-06-02 — — EP disclosed
US-7429612-B2 Indoline compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2008-09-30 — — US disclosed
CN-100349868-C Indoline compound and medical use thereof KYOTO PHARMA IND (JP) 2007-11-21 — — CN disclosed
US-20060128787-A1 Novel indoline compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2006-06-15 — — US disclosed
CN-1681781-A Novel indoline compound and medicinal use thereof KYOTO PHARMA IND (JP) 2005-10-12 — — CN disclosed
EP-1541553-A1 NOVEL INDOLINE COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2005-06-15 — — EP disclosed
US-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 — — 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 (2 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-20060128787-A1 Novel indoline compound and medicinal use thereof ACAT2, ACAT1, ACOX1 NOTUM 219/4885KDM4E 1777/4885ALDH1A1 94/4885
US-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 NOTUM 804/4885KDM4E 2600/4885ALDH1A1 2901/4885

“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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