SCHEMBL24939698

SCHEMBL24939698

CC1=C(C)C(=O)N(c2c(I)cc(C(=O)O)cc2I)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 3/20 0.48
PARP1 P09874 1/20 0.39
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
NSD2 O96028 1/20 0.38
G6PD P11413 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
NR4A1 P22736 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA9 Q16790 3/20 0.36
HCAR1 Q9BXC0 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
GAA P10253 1/20 0.33
NOTUM Q6P988 1/20 0.33
TYMS P04818 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
SCHEMBL24939798 0.80 TPMT (0.43) TPMTNSD2G6PDKEAP1NFE2L2
SCHEMBL24939670 0.78 MYC (0.45) TPMTPARP1PARP15PARP10CA12
SCHEMBL24939693 0.78 TSHR (0.38) TPMTPARP1PARP15PARP10
SCHEMBL24939694 0.78 TPMT (0.44) TPMTNSD2G6PDKEAP1NFE2L2
SCHEMBL24939788 0.78 NSD2 (0.58) TPMTNSD2G6PDKEAP1NFE2L2
SCHEMBL11443323 0.76 NSD2 (0.55) TPMTPARP1PARP15PARP10NSD2
SCHEMBL25610863 0.72 TPMT (0.65) TPMTNR4A1CA12CA1CA9
SCHEMBL1613916 0.69 TPMT (0.68) TPMTCA12CA1CA9HCAR1
SCHEMBL3034623 0.68 CA9 (0.65) PARP1PARP15PARP10CA12CA1
SCHEMBL24939856 0.68 TSHR (0.50) CA12CA1CA9NPSR1GAA

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-20230022129-A1 RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-01-26 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-20230022129-A1 RESIST MATERIAL AND PATTERNING PROCESS GFER, LBR, PCNA TPMT 985/4885PARP1 2195/4885PARP15 2044/4885

“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.