SCHEMBL30133998

SCHEMBL30133998

CCn1cc(Br)c(C(C)O)n1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.50
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPK1 P28482 2/20 0.43
RAB9A P51151 7/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 9/20 0.38
GAA P10253 2/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HTT P42858 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
TSHR P16473 1/20 0.35
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 3/20 0.34

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
SCHEMBL12507686 0.85 NPC1 (0.49) NPC1ALDH1A1KDM4EMAPK1RAB9A
SCHEMBL29911994 0.79 NPC1 (0.47) NPC1ALDH1A1KDM4EMAPK1RAB9A
SCHEMBL15742226 0.75 NPSR1 (0.36) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL31728113 0.74 HTT (0.32) NPC1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL2186271 0.72 ALDH1A1 (0.37) NPC1ALDH1A1KDM4EMAPK1
SCHEMBL31728040 0.72 NPC1 (0.38) NPC1ALDH1A1KDM4EMAPK1RAB9A
SCHEMBL13059139 0.70
SCHEMBL25107872 0.70 ALDH1A1 (0.31) NPC1ALDH1A1KDM4EMAPK1SMN1; SMN2
SCHEMBL22061443 0.69 NPC1 (0.49) NPC1ALDH1A1KDM4EMAPK1RAB9A
SCHEMBL23400503 0.69 HTT (0.36) NPC1ALDH1A1KDM4EMAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025235874-A1 HETEROCYCLICS AS EGFR INHIBITORS SCHRÖDINGER, INC. (US) 2025-11-13 WO disclosed
CN-119119033-A Pyrazolopyridone compounds 百济神州有限公司 2024-12-13 CN disclosed
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
EP-4380936-A1 PYRAZOLOPYRIDINONE COMPOUNDS BeiGene, Ltd. (KY) 2024-06-12 EP disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
WO-2023011456-A1 PYRAZOLOPYRIDINONE COMPOUNDS BEIGENE, LTD. (KY) 2023-02-09 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 (2 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-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK NPC1 2052/4885ALDH1A1 1296/4885KDM4E 2009/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK NPC1 2052/4885ALDH1A1 1296/4885KDM4E 2009/4885

“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.