SCHEMBL21180836

SCHEMBL21180836

O=C1C2CC3CC1CC(C(=O)OCC(F)(F)[SH](=O)=O)(C3)C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.37
TSHR P16473 1/20 0.37
CYP17A1 P05093 2/20 0.36
CYP19A1 P11511 2/20 0.36
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 8/20 0.36
MAPT P10636 4/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
PRKCA P17252 1/20 0.35
ATM Q13315 1/20 0.34
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.32
XBP1 P17861 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL14328352 0.87 ALDH1A1 (0.45) NPSR1CYP17A1CYP19A1ALDH1A1MAPT
SCHEMBL685920 0.84 NPSR1 (0.39) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL16589181 0.83 NPSR1 (0.38) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL17827187 0.83 NPSR1 (0.38) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL17899108 0.82 PRKCA (0.38) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL15114239 0.82 NPSR1 (0.37) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL17831323 0.81 ALDH1A1 (0.40) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL18232663 0.81 CYP17A1 (0.40) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL16169969 0.81 NPSR1 (0.36) NPSR1TSHRCYP17A1CYP19A1EPHX2
SCHEMBL3022241 0.81 NPSR1 (0.36) NPSR1TSHRCYP17A1CYP19A1EPHX2

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-10359700-B2 Salt, acid generator, photoresist composition and process of producing photoresist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-07-23 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-10359700-B2 Salt, acid generator, photoresist composition and process of producing photoresist pattern CBR1, CBR3, C1R NPSR1 389/4885TSHR 310/4885CYP17A1 1795/4885

“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.