SCHEMBL12376597

SCHEMBL12376597

CC(C)(C)c1ccc(C(=O)N2CC[C@@H](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
SCHEMBL15317648 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003662-B2 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. (US) 2011-08-23 — — US disclosed
US-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. 2007-08-23 — — 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-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ERBB2, LCK, SRC MEN1 3149/4885KMT2A 4415/4885ALDH1A1 1635/4885

“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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