SCHEMBL19250282

SCHEMBL19250282

C=Nc1ccc(C(C)(C)C)cc1SC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ PLA2G1B P04054 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ CASP3 P42574 1/20 0.31

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
SCHEMBL10282138 0.73 HPGD (0.36) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL14683210 0.72 TSHR (0.41) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL25517405 0.71 ALDH1A1 (0.40) ALDH1A1GAASMN1; SMN2L3MBTL1
SCHEMBL26090651 0.71 ALDH1A1 (0.39) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL11896567 0.71 ALDH1A1 (0.53) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL9643594 0.71 ALDH1A1 (0.59) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL25101370 0.70 ALDH1A1 (0.36) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL22932069 0.70 CRHR1 (0.38) ALDH1A1GAALMNATYR
SCHEMBL13690241 0.70 ALDH1A1 (0.36) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL22044297 0.70 TRPA1 (0.35) ALDH1A1MAPTMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233340-A1 NOVEL SUBSTITUTED 6,7-DIHYDRO-5H-BENZO[7]ANNULENE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2017-08-17 — — 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 (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-20170233340-A1 NOVEL SUBSTITUTED 6,7-DIHYDRO-5H-BENZO[7]ANNULENE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF CYP19A1, ESR1, ESR2 ALDH1A1 224/4885MAPT 4741/4885MEN1 2979/4885

“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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