SCHEMBL30447302

SCHEMBL30447302

COCCn1ncc2c(N3C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C3)c(N)ccc21

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ROCK2 O75116 1/20 0.32
MAP4K4 O95819 2/20 0.32
P2RX3 P56373 1/20 0.32
P2RX2 Q9UBL9 1/20 0.32
RET P07949 9/20 0.31
EIF2AK4 Q9P2K8 1/20 0.31
HDAC1 Q13547 2/20 0.31
PADI4 Q9UM07 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC2 Q92769 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
SCHEMBL25429189 0.89 P2RX3 (0.34) MAOAMAOBP2RX3P2RX2HDAC1
SCHEMBL25429679 0.87 DRD2 (0.33) ATMMAOAMAOBP2RX3P2RX2
SCHEMBL30447567 0.86 MAP4K4 (0.35) MAP4K4RETEIF2AK4HDAC1HDAC3
SCHEMBL31339741 0.86 MAP4K4 (0.35) MAP4K4RETEIF2AK4HDAC1HDAC3
SCHEMBL31339782 0.83 JAK1 (0.36) MAP4K4RETEIF2AK4HDAC1HDAC3
SCHEMBL30447801 0.83 JAK1 (0.36) MAP4K4RETEIF2AK4HDAC1HDAC3
SCHEMBL25430462 0.77 NTRK1 (0.36) ATM
SCHEMBL25431254 0.76 P2RX3 (0.33) MAOAMAOBP2RX3P2RX2
SCHEMBL25342939 0.73 MAP4K4 (0.38) MAP4K4RETEIF2AK4HDAC1HDAC3
SCHEMBL30447631 0.73 MAP4K4 (0.38) MAP4K4RETEIF2AK4HDAC1HDAC3

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
US-20250122174-A1 Heteroaryl Compounds As HPK1 Inhibitors And Methods Of Using Same SHENZHEN YUANLI SHENWAN INNOVATIVE MEDICINE CO LTD (CN) 2025-04-17 US disclosed
EP-4463150-A1 HETEROARYL COMPOUNDS AS HPK1 INHIBITORS AND METHODS OF USING SAME Shenzhen Ionova Life Science Co., Ltd. (CN) 2024-11-20 EP disclosed
WO-2023137406-A1 HETEROARYL COMPOUNDS AS HPK1 INHIBITORS AND METHODS OF USING SAME SHENZHEN IONOVA LIFE SCIENCE CO., LTD. (CN) 2023-07-20 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 (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-20250122174-A1 Heteroaryl Compounds As HPK1 Inhibitors And Methods Of Using Same SGK1, HYPK, PCK1 ATM 2147/4885MAOA 2987/4885MAOB 2716/4885

“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.