SCHEMBL17540304

SCHEMBL17540304

C=Cc1ccc(CN(C)CC(F)(F)C(=O)OC2CCOC2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ KDM4E B2RXH2 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ POLB P06746 1/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ATM Q13315 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
SCHEMBL17540312 0.77 ACHE (0.37) ALDH1A1GAAMEN1KMT2A
SCHEMBL17540307 0.75 — —
SCHEMBL17540308 0.75 POLB (0.34) SMN1; SMN2POLBMEN1KMT2A
SCHEMBL17545742 0.74 ATM (0.39) SMN1; SMN2KDM4EALDH1A1POLBCYP1A2
SCHEMBL17540310 0.73 HDAC6 (0.45) ALDH1A1MEN1KMT2A
SCHEMBL17354913 0.73 MAPK1 (0.40) SMN1; SMN2KDM4EALDH1A1POLBMAPK1
SCHEMBL17540313 0.70 TSHR (0.39) TSHR
SCHEMBL1895801 0.70 POLB (0.64) SMN1; SMN2KDM4EALDH1A1POLBCYP1A2
SCHEMBL17540311 0.69 HDAC6 (0.39) ALDH1A1TSHR
SCHEMBL17540309 0.68 PYCR1 (0.41) ALDH1A1

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-20160052877-A1 SALT, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-25 — — 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-20160052877-A1 SALT, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN RER1, AFF1, FRG1 SMN1; SMN2 992/4885KDM4E 1367/4885ALDH1A1 2206/4885

“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.

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