SCHEMBL25527372

SCHEMBL25527372

O=C(CS)Oc1c(I)cc(C(=O)O)cc1I

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 8/20 0.49
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA7 P43166 3/20 0.33
CA9 Q16790 3/20 0.33
CA14 Q9ULX7 3/20 0.33
FOLH1 Q04609 1/20 0.33
PLAU P00749 1/20 0.33
BPTF Q12830 1/20 0.33
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 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
SCHEMBL25527342 0.79 TPMT (0.43) TPMTPLAUBPTFPKMKMT2A
SCHEMBL17854065 0.79 TPMT (0.58) TPMTCA12CA1CA2CA7
SCHEMBL25527349 0.79 TPMT (0.41) TPMTCA12CA1CA2CA7
SCHEMBL25527351 0.79 LMNA (0.39) TPMTCA12CA1CA2CA7
SCHEMBL25527385 0.78 MAOB (0.39) TPMTPOLB
SCHEMBL25527371 0.78 TSHR (0.44) TPMTCA12CA1CA2CA7
SCHEMBL14024230 0.72 TPMT (0.81) TPMTCA12CA1CA2CA7
SCHEMBL6725053 0.71 MEN1 (0.40) TPMTALDH1A1LMNASMN1; SMN2POLB
SCHEMBL7037857 0.71 HSD11B1 (0.42) TPMT
SCHEMBL26828022 0.70 TPMT (0.52) TPMTCA12CA1CA2CA7

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-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed