SCHEMBL29428587

SCHEMBL29428587

CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CN(c1nc(Cl)nc3c1CCN(Cc1ccccc1)C3)C2

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.43
KCNK3 O14649 3/20 0.41
KCNK9 Q9NPC2 3/20 0.41
JAK1 P23458 1/20 0.40
ACHE P22303 1/20 0.40
BRS3 P32247 6/20 0.39
GPR119 Q8TDV5 1/20 0.38
CFTR P13569 2/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 3/20 0.38
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC1 Q13547 1/20 0.37
MAPT P10636 2/20 0.37

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
SCHEMBL19616920 1.00 C5AR1 (0.43) C5AR1KCNK3KCNK9JAK1ACHE
SCHEMBL26752557 0.90 JAK1 (0.39) C5AR1KCNK3KCNK9JAK1ACHE
SCHEMBL29428691 0.90 JAK1 (0.39) C5AR1KCNK3KCNK9JAK1ACHE
SCHEMBL25324710 0.88 C5AR1 (0.44) C5AR1BRS3CFTRALDH1A1GAA
SCHEMBL23409272 0.87 TMEM97 (0.42) JAK1GPR119
SCHEMBL25322135 0.87 TMEM97 (0.42) JAK1GPR119
SCHEMBL29003001 0.85 AGTR2 (0.41) JAK1GPR119HDAC1
SCHEMBL30124161 0.85 AGTR2 (0.41) JAK1GPR119HDAC1
SCHEMBL19616741 0.85 C5AR1 (0.47) C5AR1ACHEBRS3CFTR
SCHEMBL30793072 0.85 JAK1 (0.40) KCNK3KCNK9JAK1GPR119KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4216951-B1 KRAS G12D INHIBITORS MIRATI THERAPEUTICS INC (US) 2026-04-01 EP disclosed
US-20240034733-A1 KRAS G12D INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-02-01 US disclosed
US-20230357277-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-11-09 US disclosed
EP-4240489-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2023-09-13 EP disclosed
EP-4216951-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2023-08-02 EP disclosed
WO-2022098625-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2022-05-12 WO disclosed
WO-2022066646-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2022-03-31 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-20240034733-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS C5AR1 3993/4885KCNK3 4586/4885KCNK9 4514/4885
US-20230357277-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS C5AR1 3993/4885KCNK3 4586/4885KCNK9 4514/4885

“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.