SCHEMBL27458190

SCHEMBL27458190

COC(=O)CCSc1ccc2nc[nH]c(=O)c2c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 5/20 0.39
▸ GSTP1 P09211 1/20 0.39
▸ GSTM2 P28161 1/20 0.39
▸ EGFR P00533 2/20 0.37
▸ HPGD P15428 2/20 0.34
▸ SLC2A1 P11166 1/20 0.34
▸ PRNP P04156 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ CXCR1 P25024 1/20 0.33
▸ CXCR2 P25025 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ABL1 P00519 1/20 0.32
▸ RIN1 Q13671 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ EIF4EBP1 Q13541 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
SCHEMBL24879349 0.89 KDM4E (0.40) PARP1HPGDPOLBKMT2AALDH1A1
SCHEMBL30987312 0.80 CYP3A4 (0.42) PARP1ALDH1A1HSD17B10TDP1
SCHEMBL24878854 0.75 MEN1 (0.44) GSTP1GSTM2HPGDKMT2AALDH1A1
SCHEMBL29506060 0.71 KMT2A (0.45) GSTP1GSTM2PRNPPOLBKMT2A
SCHEMBL18319841 0.71 KMT2A (0.45) GSTP1GSTM2PRNPPOLBKMT2A
SCHEMBL29069631 0.71 GSTP1 (0.39) GSTP1GSTM2EGFRHPGDPRNP
SCHEMBL30321002 0.71 GSTP1 (0.39) GSTP1GSTM2EGFRHPGDPRNP
SCHEMBL24879352 0.71 HPGD (0.43) PARP1HPGDPOLBKMT2AALDH1A1
SCHEMBL18320486 0.70 KMT2A (0.44) GSTP1GSTM2PRNPPOLBKMT2A
SCHEMBL29603922 0.70 KMT2A (0.44) GSTP1GSTM2PRNPPOLBKMT2A

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-12029739-B2 SHP2 inhibitor and use thereof KANAPH THERAPEUTICS INC. (KR) 2024-07-09 — — 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-12029739-B2 SHP2 inhibitor and use thereof PTPN1, PTPN5, PTPN2 PARP1 4212/4885GSTP1 1061/4885GSTM2 1965/4885

“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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