SCHEMBL21541863

SCHEMBL21541863

CC1CN(c2nnc3cnc4ccc(Br)cc4n23)CC(C)N1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.38
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
PRKDC P78527 10/20 0.36
ATR Q13535 10/20 0.36
ATRIP Q8WXE1 10/20 0.36
PIK3CB P42338 9/20 0.36
ATM Q13315 5/20 0.36
MTOR P42345 6/20 0.35
SERPINA2 P20848 5/20 0.35
MET P08581 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
NPM1 P06748 1/20 0.34
ALK Q9UM73 1/20 0.34
PTPN11 Q06124 1/20 0.33
CACNA2D1 P54289 3/20 0.33

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
SCHEMBL30359498 1.00 SIGMAR1 (0.38) SIGMAR1LMNAKMT2APRKDCATR
SCHEMBL20374558 1.00 SIGMAR1 (0.38) SIGMAR1LMNAKMT2APRKDCATR
SCHEMBL30359501 0.86 PRKDC (0.37) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541858 0.86 PRKDC (0.37) PRKDCATRATRIPPIK3CBATM
SCHEMBL20374559 0.86 PRKDC (0.37) PRKDCATRATRIPPIK3CBATM
SCHEMBL2463549 0.80 HTT (0.45) PRKDCATRATRIPPIK3CBATM
SCHEMBL21541888 0.74 PTPN11 (0.39) LMNAKMT2AMETPDE3BPDE3A
SCHEMBL30359508 0.74 PTPN11 (0.39) LMNAKMT2AMETPDE3BPDE3A
SCHEMBL797783 0.73 NPM1 (0.42) LMNAPRKDCATRATRIPPIK3CB
SCHEMBL796862 0.71 PRKDC (0.55) PRKDCATRATRIPPIK3CBATM

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
EP-3567041-B1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF IMPACT THERAPEUTICS SHANGHAI INC (CN) 2023-12-27 EP disclosed
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 EP disclosed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 US disclosed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 EP 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-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof CHEK1, CHEK2, CDK1 SIGMAR1 2907/4885LMNA 2610/4885KMT2A 1083/4885

“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.