SCHEMBL4819667

SCHEMBL4819667

CCOC(=O)C(CCSC)Nc1ccc(N)cc1C

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPID Q08752 3/20 0.56
USP2 O75604 1/20 0.48
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
RAD52 P43351 1/20 0.38
DRD1 P21728 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL4823252 0.91 USP2 (0.58) PPIDUSP2TAS1R3TAS1R1L3MBTL1
SCHEMBL4829854 0.84 L3MBTL1 (0.51) PPIDL3MBTL1CYP1A2MAPTCYP2C9
SCHEMBL5930500 0.84 CYP1A2 (0.42) PPIDL3MBTL1CYP1A2MAPTCYP2C9
SCHEMBL2328021 0.82 PPID (0.48) PPIDUSP2TAS1R3TAS1R1L3MBTL1
SCHEMBL4816369 0.82 PPID (0.63) PPIDUSP2TAS1R3TAS1R1L3MBTL1
SCHEMBL27974660 0.82 PPID (0.48) PPIDUSP2TAS1R3TAS1R1L3MBTL1
SCHEMBL5930467 0.81 CYP1A2 (0.44) PPIDL3MBTL1CYP1A2MAPTCYP2C9
SCHEMBL6100982 0.79 PPID (0.43) PPIDCYP1A2MAPTCYP2C9CYP2C19
SCHEMBL4817666 0.78 PPID (0.50) PPIDUSP2TAS1R3TAS1R1L3MBTL1
SCHEMBL4816519 0.76 ELANE (0.52) CYP1A2MAPTCYP2C9CYP2C19SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US claimed
US-20060005321-A1 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'OREAL S.A. (FR) 2006-01-12 US claimed
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US disclosed
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US disclosed
US-7347879-B2 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'Oreál, S.A. (FR) 2008-03-25 US disclosed
US-20060005321-A1 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof L'OREAL S.A. (FR) 2006-01-12 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-20060005321-A1 Sulfur-containing secondary para-phenylenediamines dye compositions comprising such para-phenylenediamines, processes, and uses thereof KRT18, CDC73, DSG1 PPID 369/4885USP2 1779/4885TAS1R3 1152/4885

“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.