SCHEMBL14095973

SCHEMBL14095973

CC(C)(C)c1ccc(NC(=S)NC(=O)c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 12/20 0.59
SIRT2 Q8IXJ6 9/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
MAPT P10636 3/20 0.58
ALDH1A1 P00352 2/20 0.58
LMNA P02545 1/20 0.58
SIRT3 Q9NTG7 1/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL12067341 0.88 SIRT1 (0.71) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL14095968 0.86 ALDH1A1 (0.55) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL28662121 0.85 SIRT1 (0.68) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL5445610 0.85 MAPT (0.71) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL4628463 0.85 NPC1 (0.55) SMN1; SMN2MAPTALDH1A1NPC1RAB9A
SCHEMBL28330745 0.84 SMN1; SMN2 (0.78) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL14095963 0.83 ALDH1A1 (0.62) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL14095964 0.83 EPHX1 (0.63) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL14095975 0.83 SIRT2 (0.60) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1
SCHEMBL907582 0.82 SIRT1 (0.65) SIRT1SIRT2SMN1; SMN2MAPTALDH1A1

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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 US disclosed
US-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv RNASE1, SARS1, EIF2AK2 SIRT1 4376/4885SIRT2 4612/4885SMN1; SMN2 4344/4885

“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.