SCHEMBL24879353

SCHEMBL24879353

Cc1nc2ccc(S)c(Cl)c2c(=O)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 4/20 0.58
TYMS P04818 14/20 0.56
ALDH1A1 P00352 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44
BMPR1B O00238 1/20 0.42
RAF1 P04049 1/20 0.42
BRAF P15056 1/20 0.42
BMPR1A P36894 1/20 0.42
ACVR1B P36896 1/20 0.42
TGFBR1 P36897 1/20 0.42
ACVRL1 P37023 1/20 0.42
ACVR1 Q04771 1/20 0.42

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
SCHEMBL23229338 0.84 PARP1 (0.58) PARP1TYMSALDH1A1TNKS2BMPR1B
SCHEMBL16306348 0.83 PARP1 (0.61) PARP1TYMSALDH1A1TNKS2
SCHEMBL19992101 0.83 PARP1 (0.66) PARP1TYMSALDH1A1TNKS2BMPR1B
SCHEMBL19992061 0.81 PARP1 (0.62) PARP1TYMSALDH1A1TNKS2BMPR1B
SCHEMBL19992076 0.77 PARP1 (0.66) PARP1TYMSALDH1A1TNKS2BMPR1B
SCHEMBL19992074 0.74 PARP1 (0.62) PARP1TYMSALDH1A1TNKS2BMPR1B
SCHEMBL12169915 0.73 PARP1 (1.00) PARP1TYMSTNKS2BMPR1BRAF1
SCHEMBL30704850 0.73 PARP1 (1.00) PARP1TYMSTNKS2BMPR1BRAF1
SCHEMBL9518147 0.73 PARP1 (0.64) PARP1TYMSTNKS2BMPR1BRAF1
SCHEMBL6651474 0.72 TYMS (1.00) PARP1TYMSALDH1A1

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 5 patents. 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
US-12029739-B2 SHP2 inhibitor and use thereof KANAPH THERAPEUTICS INC. (KR) 2024-07-09 US disclosed
US-20240189306-A1 SHP2 INHIBITOR AND USE THEREOF KANAPH THERAPEUTICS INC. (KR) 2024-06-13 US disclosed
WO-2023282702-A1 SHP2 INHIBITOR AND USE THEREOF 주식회사 카나프테라퓨틱스 2023-01-12 WO disclosed
WO-2023282702-A1 SHP2 INHIBITOR AND USE THEREOF 주식회사 카나프테라퓨틱스 2023-01-12 WO 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 (2 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-20240189306-A1 SHP2 INHIBITOR AND USE THEREOF PTPN1, PTPN5, PTPN2 PARP1 4212/4885TYMS 4532/4885ALDH1A1 3565/4885
US-12029739-B2 SHP2 inhibitor and use thereof PTPN1, PTPN5, PTPN2 PARP1 4212/4885TYMS 4532/4885ALDH1A1 3565/4885

“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.