SCHEMBL31583752

SCHEMBL31583752

O=C(NC1CC1)c1cccnc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.58
ALDH1A1 P00352 3/20 0.57
KDM4E B2RXH2 1/20 0.57
GAA P10253 1/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
RAB9A P51151 1/20 0.55
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
NPC1 O15118 1/20 0.51
CNR2 P34972 3/20 0.50
CNR1 P21554 2/20 0.50
EGFR P00533 1/20 0.50
GRM5 P41594 1/20 0.50
HSD11B1 P28845 1/20 0.49
GFER P55789 1/20 0.49

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
SCHEMBL3165964 0.92 ALDH1A1 (0.68) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL6063992 0.92 P2RX7 (0.54) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL27842745 0.89 ALDH1A1 (0.48) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL3108907 0.89 RAB9A (0.49) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL3108915 0.89 RAB9A (0.49) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL3115088 0.89 RAB9A (0.49) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL13929047 0.86 POLB (0.50) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL4180056 0.86 POLB (0.50) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL6467378 0.82 RAB9A (0.46) P2RX7ALDH1A1KDM4EGAAMEN1
SCHEMBL6467380 0.82 RAB9A (0.46) P2RX7ALDH1A1KDM4EGAAMEN1

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-20260015325-A1 ALKOXY HETEROARYL- CARBOXAMIDE OR THIOAMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2026-01-15 US disclosed
WO-2025104032-A1 NOVEL CARBOXAMIDE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-05-22 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-20260015325-A1 ALKOXY HETEROARYL- CARBOXAMIDE OR THIOAMIDE COMPOUNDS CYCS, CBR3, CBR1 P2RX7 2152/4885ALDH1A1 1308/4885KDM4E 3892/4885

“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.