SCHEMBL11947174

SCHEMBL11947174

CC(C)(C)OC(=O)Nc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ RAB9A P51151 4/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ ABCC9 O60706 2/20 0.56
▸ ABCC8 Q09428 2/20 0.56
▸ KCNJ11 Q14654 2/20 0.56
▸ PDK1 Q15118 2/20 0.56
▸ PDK2 Q15119 2/20 0.56
▸ PDK3 Q15120 2/20 0.56
▸ KCNJ8 Q15842 2/20 0.56
▸ PDK4 Q16654 2/20 0.56
▸ ABCB11 O95342 1/20 0.56
▸ NAMPT P43490 1/20 0.56
▸ HPGD P15428 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ HTT P42858 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55

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
SCHEMBL14274234 0.92 CYP17A1 (0.59) ALDH1A1L3MBTL1RAB9AMEN1KMT2A
SCHEMBL2062613 0.87 NAMPT (0.67) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL8770870 0.87 NAMPT (0.67) RAB9AMEN1KMT2ANPC1NAMPT
SCHEMBL9646358 0.86 PDK1 (0.59) L3MBTL1RAB9AMEN1KMT2APDK1
SCHEMBL775002 0.86 NAMPT (0.56) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL17526122 0.86 NAMPT (0.73) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL8738157 0.86 CYP17A1 (0.51) ALDH1A1L3MBTL1RAB9AMEN1KMT2A
SCHEMBL243401 0.85 CYP17A1 (0.56) ALDH1A1MEN1KMT2ANAMPTCYP17A1
SCHEMBL13055402 0.84 CYP17A1 (0.59) ALDH1A1L3MBTL1NAMPTSMN1; SMN2CYP17A1
SCHEMBL3461792 0.83 SMN1; SMN2 (0.59) RAB9AMEN1KMT2ANPC1NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111362942-B Sophoridine derivative with multi-target anti-tumor activity and preparation method and application thereof 天津市医药科学研究所 2022-07-05 — — CN claimed
CN-111362942-A Sophoridine derivative with multi-target anti-tumor activity and preparation method and application thereof 天津市医药科学研究所 2020-07-03 — — CN claimed
CN-111362942-B Sophoridine derivative with multi-target anti-tumor activity and preparation method and application thereof 天津市医药科学研究所 2022-07-05 — — CN disclosed
CN-111362942-A Sophoridine derivative with multi-target anti-tumor activity and preparation method and application thereof 天津市医药科学研究所 2020-07-03 — — CN disclosed
CN-101829602-B Catalytic system for preparing N-Boc-aromatic amine compounds and preparation method and application thereof ZHENZHOU TETRANOV BIOPHARM CO LTD 2012-09-26 — — CN disclosed
US-8232402-B2 Quinolinone farnesyl transferase inhibitors for the treatment of synucleinopathies and other indications LINK MEDICINE CORPORATION (US) 2012-07-31 — — US disclosed
CN-101829602-A Catalytic system for preparing N-Boc-aromatic amine compounds and preparation method and application thereof ZHENZHOU TETRANOV BIOPHARM CO LTD 2010-09-15 — — CN disclosed
US-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS ASTRAZENECA AB (SE) 2009-10-08 — — 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-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS PANK1, PANK3, PANK2 ALDH1A1 2151/4885L3MBTL1 1324/4885RAB9A 330/4885

“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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