SCHEMBL17545742

SCHEMBL17545742

C=Cc1ccc(S(=O)(=O)N(C)S(=O)(=O)C(F)(F)C(=O)OC2CCOC2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ KDM4E B2RXH2 4/20 0.37
▸ POLB P06746 3/20 0.36
▸ TDP1 Q9NUW8 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ CASP6 P55212 1/20 0.32
▸ TSHR P16473 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
SCHEMBL17545686 0.81 ATM (0.39) ATMALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL17545747 0.79 TDP1 (0.40) ALDH1A1HPGDKDM4EPOLBTDP1
SCHEMBL17545745 0.77 — —
SCHEMBL17545746 0.75 MMP3 (0.36) ALDH1A1POLB
SCHEMBL17540304 0.74 SMN1; SMN2 (0.38) ATMALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL17545698 0.74 SCN9A (0.35) ATMALDH1A1
SCHEMBL17545696 0.72 TSHR (0.36) TSHR
SCHEMBL17545697 0.70 TDP1 (0.44) ATMALDH1A1SMN1; SMN2TDP1
SCHEMBL1895801 0.70 POLB (0.64) ATMALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL17545699 0.70 SCN9A (0.36) 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 ATM 3816/4885ALDH1A1 2206/4885HPGD 4588/4885

“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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