SCHEMBL30139656

SCHEMBL30139656

NCc1cc(Cl)c(Cl)cc1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PNMT P11086 3/20 0.41
TAAR1 Q96RJ0 6/20 0.39
LOXL2 Q9Y4K0 1/20 0.35
DPP4 P27487 1/20 0.35
KDM1A O60341 2/20 0.32
KDM1B Q8NB78 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SLC6A3 Q01959 2/20 0.31
SLC6A4 P31645 1/20 0.31
NOTUM Q6P988 1/20 0.31
PTPN5 P54829 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL30350517 0.88 PNMT (0.39) PNMTTAAR1LOXL2DPP4KDM1A
SCHEMBL1765257 0.88 PNMT (0.39) PNMTTAAR1LOXL2DPP4KDM1A
SCHEMBL27807410 0.82 PNMT (0.35) PNMTTAAR1LOXL2DPP4
SCHEMBL31593875 0.82 CD44 (0.41) PNMTTAAR1LOXL2DPP4
SCHEMBL13527770 0.81 LOXL2 (0.42) TAAR1LOXL2DPP4MEN1MAPT
SCHEMBL1764780 0.80 PNMT (0.41) PNMTTAAR1LOXL2DPP4KDM1A
SCHEMBL27717591 0.79 PNMT (0.33) PNMTTAAR1MAPT
SCHEMBL620594 0.76 DPP4 (0.46) TAAR1LOXL2DPP4MEN1MAPT
SCHEMBL626553 0.75 PNMT (0.50) PNMTTAAR1DPP4
SCHEMBL31618915 0.75 RAB9A (0.35) TAAR1MEN1MAPTKMT2AATM

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-11583538-B2 Substituted pyrrolo[1,2-a]pyrazines and pyrrolo[1,2-a][1,4]diazepines as TREX1 inhibitors Venenum Biodesign, LLC (US) 2023-02-21 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-11583538-B2 Substituted pyrrolo[1,2-a]pyrazines and pyrrolo[1,2-a][1,4]diazepines as TREX1 inhibitors TMX1, P2RX1, TCOF1 PNMT 2492/4885TAAR1 83/4885LOXL2 3964/4885

“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.