SCHEMBL23518950

SCHEMBL23518950

O=C(O)c1cc(I)ccc1OC(F)(F)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.41
▸ PTPRC P08575 1/20 0.41
▸ PTPN2 P17706 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ PTPRA P18433 1/20 0.41
▸ PTPRB P23467 1/20 0.41
▸ PTPRE P23469 1/20 0.41
▸ PTPN6 P29350 1/20 0.41
▸ MAP2K1 Q02750 7/20 0.38
▸ MAP2K2 P36507 2/20 0.38
▸ CFD P00746 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ APP P05067 1/20 0.34
▸ TPMT P51580 1/20 0.33
▸ IDO1 P14902 1/20 0.33

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
SCHEMBL23518947 0.85 NOTUM (0.53) NOTUMPTPRCPTPN2PTPN1PTPRA
SCHEMBL23518968 0.82 GABRA1 (0.42) NOTUMMAP2K1MAP2K2KDM4EALDH1A1
SCHEMBL23519131 0.78 SLC6A4 (0.42) NOTUMHSD17B10EPHX2
SCHEMBL24361197 0.78 SCN8A (0.38) NOTUMUSP2ALDH1A1HPGDHSD17B10
SCHEMBL23518973 0.77 NOTUM (0.38) NOTUM
SCHEMBL3296817 0.75 PTPRC (0.47) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL23518943 0.74 MAOB (0.39) NOTUMPTPRCPTPN2PTPN1PTPRA
SCHEMBL233846 0.74 APP (0.55) PTPRCPTPN2PTPN1PTPRAPTPRB
SCHEMBL23519000 0.72 TRPV1 (0.49) NOTUMPTPN1ALDH1A1CYP2C19HSD17B10
SCHEMBL695647 0.72 CES2 (0.48) NOTUMPTPRCPTPN2PTPN1PTPRA

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-20210179554-A1 ONIUM SALT COMPOUND, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-06-17 — — 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-20210179554-A1 ONIUM SALT COMPOUND, CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SLC6A5, LIFR, SLC6A9 NOTUM 576/4885PTPRC 3857/4885PTPN2 3556/4885

“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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