SCHEMBL24936244

SCHEMBL24936244

COc1cc(Cl)nc(OCCCNC(=O)OC(C)(C)C)c1C(=O)CC#N

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
STK17B O94768 1/20 0.41
STK17A Q9UEE5 1/20 0.41
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
BRD4 O60885 5/20 0.38
DRD2 P14416 5/20 0.37
ATM Q13315 1/20 0.36
STING1 Q86WV6 1/20 0.36

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
SCHEMBL29828059 1.00 KCNH2 (0.44) KCNH2STK17BSTK17ACA12CA1
SCHEMBL24936290 0.86 STK17B (0.46) KCNH2STK17BSTK17ACA12CA1
SCHEMBL30522690 0.86 STK17B (0.46) KCNH2STK17BSTK17ACA12CA1
SCHEMBL24485511 0.85 KCNH2 (0.52) KCNH2CA12CA1CA2CA9
SCHEMBL30615075 0.81 KCNH2 (0.37) KCNH2BRD4ATMSTING1
SCHEMBL29045179 0.80 CHEK1 (0.35) KCNH2
SCHEMBL19007377 0.80 DRD2 (0.46) KCNH2CA12CA1CA2CA9
SCHEMBL24936245 0.80 STK17B (0.41) KCNH2STK17BSTK17ACA12CA1
SCHEMBL24485105 0.75 STK17B (0.47) STK17BSTK17ACA12CA1CA2
SCHEMBL29827348 0.74 STK17B (0.41) KCNH2STK17BSTK17ACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023229032-A1 THERAPEUTIC FOR CANCER REFRACTORY TO IMMUNE CHECKPOINT INHIBITOR 住友ファーマ株式会社 2023-11-30 WO disclosed
US-11564920-B2 5-heteroaryl-1H-pyrazol-3-amine derivative Sumitomo Pharma Co., Ltd. (JP) 2023-01-31 US disclosed
US-20230025065-A1 5-HETEROARYL-1H-PYRAZOL-3-AMINE DERIVATIVE Sumitomo Pharma 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 (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-11564920-B2 5-heteroaryl-1H-pyrazol-3-amine derivative CHEK1, CHEK2, RB1 KCNH2 2700/4885STK17B 529/4885STK17A 592/4885
US-20230025065-A1 5-HETEROARYL-1H-PYRAZOL-3-AMINE DERIVATIVE CHEK1, CHEK2, RB1 KCNH2 2700/4885STK17B 529/4885STK17A 592/4885

“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.