SCHEMBL14095980

SCHEMBL14095980

CCCCOC(=O)c1ccc(NC(=S)NC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.64
MAPT P10636 5/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
KMT2A Q03164 2/20 0.64
MEN1 O00255 1/20 0.64
CYP1A2 P05177 1/20 0.63
GAA P10253 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
RECQL P46063 2/20 0.61
HPGD P15428 1/20 0.61
HTT P42858 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
RNASEL Q05823 2/20 0.56
MAPK1 P28482 1/20 0.56
RAB9A P51151 1/20 0.56
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54

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
SCHEMBL14095965 0.91 ALDH1A1 (0.63) ALDH1A1MAPTSMN1; SMN2CYP1A2GAA
SCHEMBL14137019 0.89 CYP1A2 (0.65) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL14095985 0.89 KMT2A (0.64) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL14095976 0.88 ALDH1A1 (0.61) ALDH1A1MAPTSMN1; SMN2CYP1A2GAA
SCHEMBL13956729 0.86 MAPT (0.60) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL4362279 0.85 MAPT (0.70) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL4361509 0.85 HPGD (0.75) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL13956723 0.84 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL14095962 0.84 RNASEL (0.67) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL2864417 0.83 NPC1 (0.63) ALDH1A1MAPTSMN1; SMN2KMT2ACYP1A2

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 ALDH1A1 2930/4885MAPT 4038/4885SMN1; 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.