SCHEMBL2462289

SCHEMBL2462289

CC(C)(C)C1CCc2c(sc(NC(=O)/C=C/C(=O)O)c2C#N)C1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.71
ALDH1A1 P00352 6/20 0.63
HPGD P15428 6/20 0.63
POLB P06746 4/20 0.63
LMNA P02545 4/20 0.63
GAA P10253 2/20 0.63
USP2 O75604 1/20 0.61
SMN1; SMN2 Q16637 4/20 0.59
KDM4E B2RXH2 3/20 0.59
GCGR P47871 1/20 0.57
MAPT P10636 8/20 0.57
HSD17B10 Q99714 1/20 0.57
NPSR1 Q6W5P4 1/20 0.55
SAE1 Q9UBE0 1/20 0.55
UBA2 Q9UBT2 1/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
HTT P42858 2/20 0.54
THRB P10828 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
SCHEMBL2462294 1.00 PTPN5 (0.71) PTPN5ALDH1A1HPGDPOLBLMNA
SCHEMBL3914250 0.81 THRB (0.58) PTPN5ALDH1A1HPGDPOLBLMNA
SCHEMBL3914245 0.81 THRB (0.58) PTPN5ALDH1A1HPGDPOLBLMNA
SCHEMBL2648282 0.81 ALDH1A1 (0.68) ALDH1A1HPGDPOLBLMNAGAA
SCHEMBL14581045 0.79 GCGR (0.63) ALDH1A1HPGDPOLBLMNAGAA
SCHEMBL919327 0.78 THRB (0.59) PTPN5ALDH1A1HPGDPOLBLMNA
SCHEMBL919329 0.78 THRB (0.59) PTPN5ALDH1A1HPGDPOLBLMNA
SCHEMBL2649089 0.76 POLB (0.66) ALDH1A1HPGDPOLBLMNAGAA
SCHEMBL20248982 0.75 MAPT (0.78) ALDH1A1HPGDPOLBLMNAGAA
SCHEMBL2649274 0.75 GCGR (0.76) PTPN5ALDH1A1HPGDPOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367522-A2 METHOD AND COMPOSITION FOR SKIN COLOR MODULATION Unilever Plc, A Company Registered In England And Wales under company no. 41424 of Unilever House (GB) 2011-09-28 EP disclosed
WO-2010072805-A2 METHOD AND COMPOSITION FOR COLOR MODULATION UNILEVER PLC (GB) 2010-07-01 WO disclosed
US-20100158829-A1 Method and Composition for Color Modulation CONOPCO, INC., D/B/A UNILEVER (US) 2010-06-24 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-20100158829-A1 Method and Composition for Color Modulation TYR, TH, COMT PTPN5 956/4885ALDH1A1 2383/4885HPGD 1098/4885

“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.