SCHEMBL14701402

SCHEMBL14701402

O=C1C2CC3CC1CC(C(=O)OCC(O)COC(=O)C(F)(F)S(=O)(=O)O)(C3)C2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.45
PRKCA P17252 1/20 0.38
NPSR1 Q6W5P4 3/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 6/20 0.32
KMT2A Q03164 3/20 0.32
CYP17A1 P05093 2/20 0.32
CYP19A1 P11511 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 2/20 0.32
EPHX2 P34913 1/20 0.32
GAA P10253 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL14701501 0.91 PKM (0.53) PKMPRKCANPSR1ALDH1A1KMT2A
SCHEMBL14731099 0.89 PRKCA (0.50) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL14701397 0.89 PKM (0.40) PKMPRKCA
SCHEMBL14731189 0.87 PRKCA (0.46) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL14700423 0.86 PKM (0.44) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL12977648 0.86 ALDH1A1 (0.37) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL13447544 0.86 PKM (0.42) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL21262779 0.85 PKM (0.42) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL17902834 0.84 NPSR1 (0.34) PKMPRKCANPSR1TSHRALDH1A1
SCHEMBL14240908 0.83 PKM (0.42) PKMPRKCANPSR1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8802352-B2 Salt, photoresist composition and method for producing photoresist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-12 US disclosed
US-20130040239-A1 SALT, PHOTORESIST COMPOSITION AND METHOD FOR PRODUCING PHOTORESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-14 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-20130040239-A1 SALT, PHOTORESIST COMPOSITION AND METHOD FOR PRODUCING PHOTORESIST PATTERN CRY1, H1-0, SPIN1 PKM 3615/4885PRKCA 2560/4885NPSR1 184/4885

“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.