SCHEMBL31358994

SCHEMBL31358994

C[C@@H](NC(=O)C1(n2c(=O)[nH]c3cccc(C#N)c3c2=O)CC1)c1ncc(C#N)cc1F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 6/20 0.33
▸ BDKRB1 P46663 7/20 0.33
▸ ABCC1 P33527 1/20 0.33
▸ OPRM1 P35372 1/20 0.32
▸ OPRL1 P41146 1/20 0.32
▸ S1PR3 Q99500 1/20 0.31
▸ PDPK1 O15530 1/20 0.31
▸ EGLN1 Q9GZT9 1/20 0.31
▸ KCNJ1 P48048 1/20 0.31
▸ FEN1 P39748 1/20 0.31

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
SCHEMBL31359052 1.00 KIT (0.33) KITBDKRB1ABCC1OPRM1OPRL1
SCHEMBL31359016 0.89 S1PR3 (0.34) KITBDKRB1OPRM1OPRL1S1PR3
SCHEMBL31359000 0.89 S1PR3 (0.34) KITBDKRB1OPRM1OPRL1S1PR3
SCHEMBL31359077 0.82 ELANE (0.37) PDPK1
SCHEMBL31358993 0.82 ELANE (0.37) PDPK1
SCHEMBL31359020 0.76 GPR139 (0.39) S1PR3PDPK1FEN1
SCHEMBL31359074 0.76 GPR139 (0.39) S1PR3PDPK1FEN1
SCHEMBL31161003 0.72 PDPK1 (0.36) KITS1PR3PDPK1
SCHEMBL31359025 0.72 KDM4E (0.37) KITS1PR3PDPK1
SCHEMBL31359019 0.72 PDPK1 (0.36) KITS1PR3PDPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559464-B2 Quinazolinone dione compounds and uses thereof EDGEWISE THERAPEUTICS, INC. (US) 2026-02-24 — — US disclosed
US-20250026726-A1 QUINAZOLINONE DIONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. 2025-01-23 — — 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 (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-20250026726-A1 QUINAZOLINONE DIONE COMPOUNDS AND USES THEREOF TNNI3, TNNT2, MYLK2 KIT 4669/4885BDKRB1 1015/4885ABCC1 165/4885
US-12559464-B2 Quinazolinone dione compounds and uses thereof TNNI3, TNNT2, TNNC1 KIT 4831/4885BDKRB1 869/4885ABCC1 142/4885

“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.

Send feedback