SCHEMBL21996264

SCHEMBL21996264

NC(=O)c1ccc(Br)c(Cl)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.47
ERN1 O75460 1/20 0.43
KMT2A Q03164 2/20 0.39
ATM Q13315 1/20 0.39
CASP1 P29466 2/20 0.35
CDC7 O00311 1/20 0.35
EEF2K O00418 1/20 0.35
PLK4 O00444 1/20 0.35
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
ROCK2 O75116 1/20 0.35
RPS6KA5 O75582 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
INSR P06213 1/20 0.35
CDK1 P06493 1/20 0.35
CSF1R P07333 1/20 0.35
IGF1R P08069 1/20 0.35
ROS1 P08922 1/20 0.35
PIM1 P11309 1/20 0.35

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
SCHEMBL7495208 0.82 KDM4E (0.40) ERN1CASP1CA1CA2KDM4E
SCHEMBL28221345 0.82 DGAT1 (0.52) DGAT1ERN1KMT2AATMPLK4
SCHEMBL5802725 0.80 DGAT1 (0.46) DGAT1KMT2AATMCASP1KDM4E
SCHEMBL27775492 0.80 KMT2A (0.50) DGAT1KMT2AATMCASP1CA12
SCHEMBL25211259 0.78 KMT2A (0.40) DGAT1KMT2AATMCASP1KDM4E
SCHEMBL16122584 0.78 DGAT1 (0.48) DGAT1ERN1KMT2AATMPLK4
SCHEMBL149886 0.77 DGAT1 (0.47) DGAT1ERN1PARP15PARP10KIF11
SCHEMBL18786842 0.77 ERN1 (0.43) DGAT1ERN1KMT2AATMCASP1
SCHEMBL30880334 0.77 DGAT1 (0.47) DGAT1ERN1PARP15PARP10KIF11
SCHEMBL17711410 0.77 ABL1 (0.44) ATMCASP1CA12CA1CA2

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-20220112192-A1 COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2022-04-14 US disclosed
EP-3887373-A1 COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF CANCER Araxes Pharma LLC (US) 2021-10-06 EP disclosed
CN-113227092-A Compounds and methods of use thereof for treating cancer 亚瑞克西斯制药公司 2021-08-06 CN disclosed
WO-2020113071-A1 COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2020-06-04 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-20220112192-A1 COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF CANCER KRAS, NRAS, HRAS DGAT1 2746/4885ERN1 723/4885KMT2A 2279/4885

“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.