SCHEMBL15317648

SCHEMBL15317648

CC(C)(C)c1ccc(C(=O)N2CCC(O)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.60
▸ KMT2A Q03164 7/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ HTT P42858 1/20 0.60
▸ HPGD P15428 2/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ RAB9A P51151 1/20 0.54
▸ HSP90AA1 P07900 1/20 0.53
▸ HSP90AB1 P08238 1/20 0.53
▸ HDAC4 P56524 1/20 0.51
▸ LMNA P02545 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ HSD11B1 P28845 1/20 0.49
▸ MAPK1 P28482 1/20 0.49

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
SCHEMBL12376597 1.00 MEN1 (0.60) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15317689 0.91 MEN1 (0.66) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15317685 0.91 MEN1 (0.66) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15317656 0.91 MEN1 (0.66) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15317667 0.91 MEN1 (0.69) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15317704 0.87 MEN1 (0.63) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL15470654 0.85 MEN1 (0.60) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL21977131 0.84 MEN1 (0.59) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL4617137 0.84 MEN1 (0.59) MEN1KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL12203376 0.83 HSP90AA1 (0.52) MEN1KMT2AHPGDHSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 — — US disclosed
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 — — US disclosed
US-8987314-B2 Amide, urea or sulfone amide linked benzothiazole inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-24 — — US disclosed
US-20140045811-A1 AMIDE, UREA OR SULFONE AMIDE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY 2014-02-13 — — US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 — — US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 — — 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-20140045811-A1 AMIDE, UREA OR SULFONE AMIDE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE LIPG, LIPE, CEL MEN1 4822/4885KMT2A 1708/4885ALDH1A1 732/4885
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES NFATC1, IL5, CD4 MEN1 3827/4885KMT2A 3615/4885ALDH1A1 875/4885

“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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