SCHEMBL31079159

SCHEMBL31079159

CN(Cc1cc(-c2cc(-c3cc4c(cc3F)C(=O)NCC4)c(N)nc2F)ccc1N1CCOCC1)CC1CCCO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
GPR84 Q9NQS5 3/20 0.32
SYK P43405 4/20 0.32
KDR P35968 1/20 0.31
EED O75530 1/20 0.31
RBBP4 Q09028 1/20 0.31
SUZ12 Q15022 1/20 0.31
EZH2 Q15910 1/20 0.31
AEBP2 Q6ZN18 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CASP1 P29466 1/20 0.31
CYP2C19 P33261 1/20 0.31
CASP7 P55210 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL31079163 0.93 MAPK1 (0.42) LMNAMAPK1GPR84SYKEED
SCHEMBL31079254 0.88 MAPK1 (0.36) MAPK1CYP1A2CYP2C19PDE3BPDE3A
SCHEMBL31079301 0.85 MTOR (0.37) MAPK1ALDH1A1MEN1KMT2APDE3B
SCHEMBL31079341 0.83 MAPK1 (0.36) MAPK1EEDRBBP4SUZ12EZH2
SCHEMBL31079015 0.83 MAPK1 (0.36) MAPK1EEDRBBP4SUZ12EZH2
SCHEMBL31079027 0.83 MAPK1 (0.37) MAPK1PDE3BPDE3AWDR5
SCHEMBL31078991 0.83 MAPK1 (0.35) MAPK1EEDRBBP4SUZ12EZH2
SCHEMBL31079106 0.82 AKT1 (0.34) MAPK1PDE3BPDE3AWDR5
SCHEMBL29964555 0.81 CDK4 (0.37) MAPK1PARP1
SCHEMBL31079348 0.81 ALK (0.33) MAPK1KDR

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 1 patent. 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

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 LMNA 3816/4885MAPK1 141/4885GPR84 1903/4885

“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.