SCHEMBL17059949

SCHEMBL17059949

CN1C(=O)c2ccccc2Sc2cc(N[C@H]3CC[C@H](O)CC3)ncc21

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK7 Q13164 9/20 0.70
▸ BRD4 O60885 9/20 0.70
▸ BRD2 P25440 1/20 0.52
▸ EP300 Q09472 1/20 0.52
▸ BRD3 Q15059 1/20 0.52
▸ BRDT Q58F21 1/20 0.52
▸ CREBBP Q92793 1/20 0.52
▸ MAPT P10636 4/20 0.42
▸ TP53 P04637 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CCNT1 O60563 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL17059837 0.82 MAPK7 (1.00) MAPK7BRD4BRD2EP300BRD3
SCHEMBL17059803 0.82 MAPK7 (1.00) MAPK7BRD4BRD2EP300BRD3
SCHEMBL18369858 0.82 MAPK7 (1.00) MAPK7BRD4BRD2EP300BRD3
SCHEMBL17059946 0.80 MAPK7 (1.00) MAPK7BRD4BRD2EP300BRD3
SCHEMBL18370038 0.79 MAPK7 (0.68) MAPK7BRD4BRD2EP300BRD3
SCHEMBL17059780 0.77 BRD4 (0.52) MAPK7BRD4BRDTTP53LMNA
SCHEMBL17059741 0.77 BRD4 (0.78) MAPK7BRD4BRD2EP300BRD3
SCHEMBL17059906 0.77 BRD4 (0.74) MAPK7BRD4BRD2EP300BRD3
SCHEMBL17059920 0.76 MAPK7 (0.88) MAPK7BRD4BRD2EP300BRD3
SCHEMBL18370039 0.76 MAPK7 (0.88) MAPK7BRD4BRD2EP300BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170008888-A1 HETEROCYCLIC COMPOUNDS ACTIVX BIOSCIENCES, INC. 2017-01-12 — — US disclosed
US-20170008888-A1 HETEROCYCLIC COMPOUNDS ACTIVX BIOSCIENCES, INC. 2017-01-12 — — US disclosed
WO-2015129927-A1 HETEROCYCLIC COMPOUNDS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-09-03 — — WO 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-20170008888-A1 HETEROCYCLIC COMPOUNDS BET1, EP300, RBBP5 MAPK7 58/4885BRD4 4/4885BRD2 17/4885

“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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