SCHEMBL422007

SCHEMBL422007

CC(=O)OC(Cc1ccc(O)c(O)c1)C(C)N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 8/20 0.56
RECQL P46063 7/20 0.56
KDM4E B2RXH2 7/20 0.56
TDP1 Q9NUW8 6/20 0.56
HIF1A Q16665 5/20 0.56
HSD17B10 Q99714 5/20 0.56
USP2 O75604 2/20 0.56
ADORA3 P0DMS8 2/20 0.56
HTR2A P28223 2/20 0.56
PTGS2 P35354 2/20 0.56
LCK P06239 2/20 0.56
PTGS1 P23219 2/20 0.56
EGFR P00533 1/20 0.56
FYN P06241 1/20 0.56
SLC7A5 Q01650 1/20 0.56
ALOX12 P18054 6/20 0.51
MAPT P10636 5/20 0.51
LMNA P02545 4/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 3/20 0.51

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
SCHEMBL422021 0.87 KDM4E (0.55) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL421632 0.83 TAAR1 (0.53) SLC7A5MAPTESR1SLC6A2
SCHEMBL14923029 0.83 KDM4E (0.61) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL421973 0.78 ALPI (0.53) PTGS1SLC7A5ALDH1A1HPGDCYP2D6
SCHEMBL6140245 0.78 ALOX15 (0.62) ALOX15RECQLKDM4ETDP1HIF1A
Hydrochloric Acid SCHEMBL29588252 0.77 ALOX15 (0.60) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL12137123 0.76 ALOX15 (0.74) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL19565599 0.76 ALOX15 (0.74) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL10029410 0.76 ALOX15 (0.74) ALOX15RECQLKDM4ETDP1HIF1A
SCHEMBL6473053 0.76 ALOX15 (0.64) ALOX15RECQLKDM4ETDP1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers HENKEL AG & CO. KGAA (DE) 2012-03-15 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-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers H1-0, H1-3, H1-2 ALOX15 4521/4885RECQL 375/4885KDM4E 841/4885

“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.