SCHEMBL19213282

SCHEMBL19213282

CCCOCC(O)C[N+](C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.48
USP2 O75604 2/20 0.47
HTT P42858 1/20 0.45
LPAR5 Q9H1C0 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SLC22A16 Q86VW1 1/20 0.38
PRKD3 O94806 1/20 0.36
PRKCG P05129 1/20 0.36
PRKCB P05771 1/20 0.36
PRKCA P17252 1/20 0.36
PRKCH P24723 1/20 0.36
PRKCI P41743 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCZ Q05513 1/20 0.36
PRKCD Q05655 1/20 0.36
PRKD1 Q15139 1/20 0.36
CYP1A2 P05177 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
SCHEMBL30603364 0.90 HSD17B10 (0.44) HSD17B10TDP1USP2HTTLPAR5
SCHEMBL12603727 0.89 USP2 (0.57) HSD17B10TDP1USP2HTTLPAR5
SCHEMBL2529770 0.87 HSD17B10 (0.42) HSD17B10TDP1USP2HTTLPAR5
Hydrochloric Acid SCHEMBL30298374 0.87 MAPT (0.44) HSD17B10TDP1USP2HTTLPAR5
Hydrochloric Acid SCHEMBL5479514 0.85 MAPT (0.43) HSD17B10TDP1USP2HTTLPAR5
Hydrochloric Acid SCHEMBL5479517 0.85 HSD17B10 (0.41) HSD17B10TDP1USP2HTTLPAR5
SCHEMBL7722820 0.85 USP2 (0.69) USP2HTTLPAR5MAPTPRKD3
SCHEMBL2918618 0.85 USP2 (0.69) USP2HTTLPAR5MAPTPRKD3
Hydrochloric Acid SCHEMBL11590308 0.85 USP2 (0.63) HSD17B10USP2HTTLPAR5MAPT
SCHEMBL7726473 0.85 USP2 (0.69) USP2HTTLPAR5MAPTPRKD3

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-20170224605-A1 TEMPORARY CHANGING THE COLOR OF HAIR USING PIGMENTS, ALCOHOLS AND CATIONIC CELLULOSES HENKEL AG & CO. KGAA (DE) 2017-08-10 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-20170224605-A1 TEMPORARY CHANGING THE COLOR OF HAIR USING PIGMENTS, ALCOHOLS AND CATIONIC CELLULOSES KRT18, CUTA, TYR HSD17B10 1153/4885TDP1 2602/4885USP2 4331/4885

“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.