SCHEMBL2909081

SCHEMBL2909081

Cc1ccc(S(=O)(=O)OCCCN2c3ccccc3SC2C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP24A1 Q07973 2/20 0.42
▸ LMNA P02545 2/20 0.37
▸ VDR P11473 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ PSMD10 O75832 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC10 Q969S8 1/20 0.34
▸ HDAC11 Q96DB2 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC9 Q9UKV0 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ HTR1A P08908 1/20 0.33
▸ HTR2A P28223 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
SCHEMBL9379877 0.79 DRD2 (0.49) CYP24A1LMNACYP2D6HTR1AHTR2A
SCHEMBL8861416 0.74 LMNA (0.37) LMNACYP2D6GSK3B
SCHEMBL28522889 0.73 VDR (0.33) LMNAVDRCYP2D6HDAC3HDAC4
SCHEMBL6313787 0.72 KDM1A (0.43) CYP2D6HTR1AHTR2ASLC6A4HTR7
SCHEMBL890725 0.71 ALDH1A1 (0.50) CYP24A1VDRPSMD10CYP2D6
SCHEMBL483847 0.71 ALDH1A1 (0.50) CYP24A1VDRPSMD10CYP2D6
SCHEMBL29603098 0.70 ALDH1A1 (0.38) LMNACYP2D6HTR1AHTR2ASLC6A4
SCHEMBL28399716 0.70 PIM1 (0.45) LMNACYP2D6HTR1AHTR2ASLC6A4
SCHEMBL27031272 0.70 KDM1A (0.53) CYP24A1LMNACYP2D6HDAC3HDAC4
SCHEMBL10770035 0.70 VDR (0.55) CYP24A1LMNAVDRCASP3CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217070-A1 NUCLEIC ACID FLUORESCENT STAINS Sigma-Aldrich Co. (US) 2010-08-18 — — EP disclosed
US-20100041045-A1 NUCLEIC ACID FLUORESCENT STAINS SIGMA-ALDRICH CO. (US) 2010-02-18 — — US disclosed
WO-2009064943-A1 NUCLEIC ACID FLUORESCENT STAINS SIGMA-ALDRICH CO. (US) 2009-05-22 — — WO disclosed
US-20090131279-A1 NUCLEIC ACID FLUORESCENT STAINS SIGMA ALDRICH COMPANY (US) 2009-05-21 — — 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-20090131279-A1 NUCLEIC ACID FLUORESCENT STAINS POLRMT, HNRNPH3, EWSR1 CYP24A1 3750/4885LMNA 180/4885VDR 2842/4885

“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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