SCHEMBL17778355

SCHEMBL17778355

C=C(C)C(=O)OCCOC(=O)C(OC(=O)CC12CC3CC(CC(C3)C1)C2)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
ALDH1A1 P00352 7/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 2/20 0.35
THRB P10828 2/20 0.34
EPHX2 P34913 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
MAPK1 P28482 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 2/20 0.31
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL17773475 0.88 MAPT (0.35) MAPTALDH1A1MEN1KMT2AHTT
SCHEMBL17778353 0.84 CYP17A1 (0.38) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL17754170 0.82 MEN1 (0.44) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL17754027 0.82 ALDH1A1 (0.38) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL17754171 0.81 MEN1 (0.37) MAPTALDH1A1MEN1KMT2AEPHX2
SCHEMBL17754028 0.81 ALDH1A1 (0.39) MAPTALDH1A1MEN1KMT2ATHRB
SCHEMBL17753869 0.80 ALDH1A1 (0.42) MAPTALDH1A1MEN1KMT2AATM
SCHEMBL17778264 0.80 THRB (0.34) ALDH1A1THRBTSHR
SCHEMBL17297646 0.76 THRB (0.46) ALDH1A1HTTTHRBTSHR
SCHEMBL17778267 0.75 CYP17A1 (0.33) ALDH1A1LMNATHRBNPSR1TSHR

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-20160145186-A1 NON-IONIC COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-26 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-20160145186-A1 NON-IONIC COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN AFF1, AFF2, RER1 MAPT 4492/4885ALDH1A1 2381/4885MEN1 3688/4885

“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.