SCHEMBL29964239

SCHEMBL29964239

Nc1nc(F)c(-c2ccc(N3CCC(F)CC3)cc2)cc1-c1ccc2c(c1)CCNC2=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
CCNT1 O60563 1/20 0.44
CDK4 P11802 1/20 0.44
CCNA2 P20248 1/20 0.44
CCND1 P24385 1/20 0.44
CDK2 P24941 1/20 0.44
CCND3 P30281 1/20 0.44
CDK7 P50613 1/20 0.44
CDK9 P50750 1/20 0.44
CCNH P51946 1/20 0.44
MNAT1 P51948 1/20 0.44
CDK6 Q00534 1/20 0.44
PARP10 Q53GL7 5/20 0.43
PARP11 Q9NR21 5/20 0.43
MAPKAPK2 P49137 8/20 0.42
MAPK9 P45984 1/20 0.42
TGFBR1 P36897 1/20 0.42
ACVR1 Q04771 1/20 0.42
GSK3B P49841 2/20 0.42
PIM1 P11309 1/20 0.38

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
SCHEMBL29964786 0.94 MAPK1 (0.48) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29964133 0.94 MAPK1 (0.48) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL31079357 0.93 MAPK1 (0.47) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29964732 0.92 MAPK1 (0.52) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29964474 0.92 MAPK1 (0.46) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29965003 0.91 CCNT1 (0.53) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL31079160 0.91 MAPK1 (0.45) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29964678 0.90 MAPK1 (0.45) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL31079127 0.89 MAPK1 (0.45) MAPK1CCNT1CDK4CCNA2CCND1
SCHEMBL29964601 0.88 MAPK1 (0.43) MAPK1CCNT1CDK4CCNA2CCND1

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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2024-10-17 US disclosed
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE 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-20240343704-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) CMPK1, WNK1, AAK1 MAPK1 141/4885CCNT1 604/4885CDK4 258/4885

“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.