SCHEMBL27157752

SCHEMBL27157752

CC(C)N1CCN(c2ccc(-c3cnc(N)c(-c4ccc5c(c4)CCNC5=O)n3)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.48
▸ CCNT1 O60563 2/20 0.47
▸ CDK4 P11802 2/20 0.47
▸ CCNA2 P20248 2/20 0.47
▸ CCND1 P24385 2/20 0.47
▸ CDK2 P24941 2/20 0.47
▸ CCND3 P30281 2/20 0.47
▸ CDK7 P50613 2/20 0.47
▸ CDK9 P50750 2/20 0.47
▸ CCNH P51946 2/20 0.47
▸ MNAT1 P51948 2/20 0.47
▸ CDK6 Q00534 2/20 0.47
▸ MAPK1 P28482 1/20 0.44
▸ FYN P06241 1/20 0.41
▸ ALK Q9UM73 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ TGFBR1 P36897 3/20 0.41
▸ ACVR1 Q04771 3/20 0.41
▸ BMPR1B O00238 2/20 0.41
▸ BMPR1A P36894 2/20 0.41

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
SCHEMBL27157789 0.91 CHEK1 (0.59) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157879 0.89 CHEK1 (0.44) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157527 0.88 CDK4 (0.49) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL29157651 0.87 MAPK1 (0.42) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157621 0.87 MAPK1 (0.42) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157797 0.87 MAPK1 (0.54) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157730 0.87 CHEK1 (0.52) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL30041104 0.87 CHEK1 (0.52) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27157654 0.85 CHEK1 (0.57) CHEK1CCNT1CDK4CCNA2CCND1
SCHEMBL27160058 0.85 CCNT1 (0.41) CCNT1CDK4CCNA2CCND1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317723-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-09-26 — — US disclosed
EP-4330252-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) Ontario Institute for Cancer Research (OICR) (CA) 2024-03-06 — — EP disclosed
CN-117597340-A Substituted amino-aza-heteroaryl compounds as inhibitors of hematopoietic progenitor kinase 1 (HPK 1) 安大略省癌症研究所(OICR) 2024-02-23 — — CN disclosed
WO-2022226666-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — 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-20240317723-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) DCK, CMPK1, PHKA1 CHEK1 256/4885CCNT1 659/4885CDK4 280/4885

“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.

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