SCHEMBL4109331

SCHEMBL4109331

CCC(=O)c1cccc2c(OC)cccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.59
CYP2C9 P11712 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
STAT6 P42226 1/20 0.54
CDC25B P30305 3/20 0.50
PLK1 P53350 1/20 0.49
HMGCR P04035 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
HIF1A Q16665 1/20 0.47
NPC1 O15118 1/20 0.45
CTSD P07339 1/20 0.45
CTNNB1 P35222 1/20 0.44
WNT3A P56704 1/20 0.44
HPGD P15428 2/20 0.44

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
SCHEMBL4097579 0.90 HPGDS (0.73) HPGDSCYP2C9ALDH1A1HSD17B10CYP1A2
SCHEMBL10455303 0.83 HPGDS (0.52) HPGDSCYP2C9ALDH1A1HSD17B10CYP1A2
SCHEMBL878658 0.82 NPC1 (0.64) ALDH1A1HMGCRKMT2ANPC1CTSD
SCHEMBL29738645 0.82 NPC1 (0.64) ALDH1A1HMGCRKMT2ANPC1CTSD
SCHEMBL5307288 0.81 HMGCR (0.50) ALDH1A1HMGCRKMT2AMEN1NPC1
SCHEMBL13089201 0.81 HMGCR (0.50) HMGCRNPC1CTSD
SCHEMBL3661643 0.81 HPGD (0.54) ALDH1A1HSD17B10HMGCRKMT2AMEN1
SCHEMBL28839615 0.81 TAS1R3 (0.57) ALDH1A1HSD17B10CYP3A4HMGCRKMT2A
SCHEMBL4103770 0.80 CDC25B (0.68) HPGDSCYP2C9ALDH1A1HSD17B10CDC25B
SCHEMBL835587 0.80 MAPT (0.58) HPGDSCYP2C9ALDH1A1HSD17B10CYP1A2

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
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221645-A1 Dihydroimidazothiazole Derivatives PROSIDION LIMITED (GB) 2009-09-03 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-20090221645-A1 Dihydroimidazothiazole Derivatives TPH1, HTR3B, HTR1A HPGDS 2194/4885CYP2C9 293/4885ALDH1A1 195/4885

“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.