SCHEMBL19912097

SCHEMBL19912097

CCCCc1ccc2sc3c4cc5cc(-c6ccccc6)ccc5cc4sc3c2c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 1/20 0.39
▸ HSD11B1 P28845 2/20 0.38
▸ PTPN1 P18031 4/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ PIM1 P11309 1/20 0.35
▸ PIM3 Q86V86 1/20 0.35
▸ PIM2 Q9P1W9 1/20 0.35
▸ EP300 Q09472 1/20 0.35
▸ KAT2A Q92830 1/20 0.35
▸ KAT2B Q92831 1/20 0.35
▸ RARB P10826 1/20 0.35
▸ LIMK1 P53667 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ EIF4A1 P60842 1/20 0.33

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
SCHEMBL19912086 0.95 HSD11B1 (0.38) HSD11B1RARBTRPV1
SCHEMBL19912076 0.95 HSD11B1 (0.38) HSD11B1RARBTRPV1
SCHEMBL19912110 0.95 HSD11B1 (0.38) HSD11B1RARBTRPV1
SCHEMBL19912102 0.95 HSD11B1 (0.38) HSD11B1RARBTRPV1
SCHEMBL19912084 0.95 HSD11B1 (0.38) HSD11B1RARBTRPV1
SCHEMBL19912079 0.95 PSMB5 (0.41) PSMB5HSD11B1PTPN1DHODHPIM1
SCHEMBL19912080 0.92 HSD11B1 (0.41) HSD11B1PIM1PIM3PIM2EP300
SCHEMBL19912109 0.92 HSD11B1 (0.41) HSD11B1PIM1PIM3PIM2EP300
SCHEMBL19912088 0.91 HSD11B1 (0.38) PSMB5HSD11B1PIM1PIM3PIM2
SCHEMBL30423446 0.91 HSD11B1 (0.38) PSMB5HSD11B1PIM1PIM3PIM2

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-20180062087-A1 Organic Compound, Organic Semiconductor Material, Organic Thin Film And Method For Producing The Same, Organic Semiconductor Composition, And Organic Semiconductor Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2018-03-01 — — US disclosed
US-20180062087-A1 Organic Compound, Organic Semiconductor Material, Organic Thin Film And Method For Producing The Same, Organic Semiconductor Composition, And Organic Semiconductor Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2018-03-01 — — 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-20180062087-A1 Organic Compound, Organic Semiconductor Material, Organic Thin Film And Method For Producing The Same, Organic Semiconductor Composition, And Organic Semiconductor Device PROX1, NONO, PIEZO1 PSMB5 3410/4885HSD11B1 130/4885PTPN1 3092/4885

“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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