SCHEMBL26705124

SCHEMBL26705124

Cc1cc(Cl)nc(Cl)c1F

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 2/20 0.34
TAAR1 Q96RJ0 1/20 0.34
POLB P06746 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
SCHEMBL22251108 0.81 SMN1; SMN2 (0.50) ALDH1A1MAPK1SMN1; SMN2KDM4EKMT2A
SCHEMBL10412140 0.81 ALDH1A1 (0.39) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL22029192 0.77 NOS3 (0.38) ALDH1A1POLB
SCHEMBL25337588 0.77 ALDH1A1 (0.36) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL11985859 0.75 ALDH1A1 (0.39) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL31396216 0.75 ALDH1A1 (0.39) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL3752930 0.75 CYP3A4 (0.40) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL18260463 0.71 TDP1 (0.44) KDM4EKMT2AMEN1
SCHEMBL8545318 0.71 ALDH1A1 (0.36) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4
SCHEMBL23797878 0.71 ALDH1A1 (0.36) ALDH1A1MAPK1SMN1; SMN2KDM4ECYP3A4

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-20230339927-A1 ATR INHIBITORS AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-10-26 US disclosed
US-20230339927-A1 ATR INHIBITORS AND USES THEREOF ANTENGENE DISCOVERY LIMITED (CN) 2023-10-26 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-20230339927-A1 ATR INHIBITORS AND USES THEREOF ATR, CHEK1, CHEK2 ALDH1A1 4462/4885MAPK1 1260/4885SMN1; SMN2 1298/4885

“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.