SCHEMBL13846705

SCHEMBL13846705

CC(c1ccc2ccccc2c1)C1SC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UGT2B7 P16662 1/20 0.46
▸ PTGER3 P43115 1/20 0.44
▸ TSHR P16473 2/20 0.43
▸ ADRA2A P08913 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ ADRA2C P18825 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ DDB1 Q16531 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ PDE2A O00408 1/20 0.38

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
SCHEMBL13846711 0.85 AKR1C3 (0.51) TSHRMAPTCYP1A2CA2
SCHEMBL31366855 0.69 CA2 (0.66) MAPTKDM4EHPGDSMN1; SMN2DDB1
SCHEMBL13749448 0.67 PSMD14 (0.59) TSHRMAPTKDM4EHPGDSMN1; SMN2
SCHEMBL99049 0.66 TSHR (0.64) PTGER3TSHRMAPTKDM4EHPGD
SCHEMBL18102338 0.66 TSHR (0.64) PTGER3TSHRMAPTKDM4EHPGD
SCHEMBL22380663 0.66 TSHR (0.64) PTGER3TSHRMAPTKDM4EHPGD
Hydrogen Peroxide SCHEMBL8096014 0.66 UGT2B7 (0.72) UGT2B7TSHRMMP9MEN1KMT2A
SCHEMBL28596057 0.66 UGT2B7 (0.55) UGT2B7TSHRADRA2AADRA2BADRA2C
Naphthalene SCHEMBL9636781 0.66 UGT2B7 (0.71) UGT2B7TSHRADRA2AADRA2BADRA2C
SCHEMBL9179436 0.66 UGT2B7 (0.71) UGT2B7TSHRADRA2AADRA2BADRA2C

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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 — — US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 — — 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB UGT2B7 2015/4885PTGER3 4401/4885TSHR 625/4885

“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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