SCHEMBL26672005

SCHEMBL26672005

N#CCNCc1ccc(Br)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.66
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 2/20 0.49
CTSK P43235 1/20 0.47
LOXL2 Q9Y4K0 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AGER Q15109 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40

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
SCHEMBL13185941 0.81 CHRM2 (0.53) PYCR1CYP2D6CYP2C19LMNALOXL2
SCHEMBL8151807 0.79 PYCR1 (0.64) PYCR1CYP1A2CYP2D6CYP2C19LMNA
SCHEMBL29171591 0.79 PYCR1 (1.00) PYCR1CYP1A2CYP2D6CYP2C19LMNA
SCHEMBL11305587 0.79 CHRM2 (0.52) PYCR1CYP1A2CYP2C19LMNALOXL2
SCHEMBL11445734 0.79 ANPEP (0.42) PYCR1LMNALOXL2CA12CA1
SCHEMBL6663240 0.79 LMNA (0.59) PYCR1CYP2D6CYP2C19LMNAMEN1
SCHEMBL653443 0.78 MEN1 (0.56) MEN1GAAMAPTKMT2A
Hydrochloric Acid SCHEMBL21552856 0.77 MAPT (0.58) MEN1GAAMAPTKMT2ACA1
SCHEMBL1901591 0.76 CHRM2 (0.58) MEN1NPC1GAAMAPTRAB9A
SCHEMBL26670320 0.76 ALDH1A1 (0.53) CYP1A2CYP2D6LMNACTSKTAAR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353853-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2025-11-20 US disclosed
EP-4563146-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2025-06-04 EP disclosed
EP-4532476-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2025-04-09 EP disclosed
CN-119630645-A Flavivirus inhibitors IRBM股份公司 2025-03-14 CN disclosed
WO-2023227734-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2023-11-30 WO disclosed
WO-2023227734-A1 FLAVIVIRUS INHIBITORS IRBM S.P.A. (IT) 2023-11-30 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-20250353853-A1 FLAVIVIRUS INHIBITORS SPINT2, EIF2AK2, DDX5 PYCR1 3669/4885CYP1A2 2301/4885CYP2D6 2947/4885

“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.