SCHEMBL17608657

SCHEMBL17608657

O=C(O)c1ccc2n[nH]cc2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.48
KDM4E B2RXH2 5/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 4/20 0.43
ALOX15 P16050 3/20 0.43
TSHR P16473 1/20 0.43
ACMSD Q8TDX5 1/20 0.43
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DAO P14920 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
GNE Q9Y223 1/20 0.35
ECE1 P42892 2/20 0.35
P4HA1 P13674 1/20 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
SCHEMBL23777268 0.83 PIM1 (0.39) KDM4EKMT2ALMNA
SCHEMBL23530002 0.80 MAPK1 (0.42) KDM4EL3MBTL1ALOX15ALDH1A1HPGD
SCHEMBL2175934 0.79 MGAM (0.64) MGAMKDM4EL3MBTL1TDP1ALOX15
SCHEMBL2022194 0.73 KDM4E (0.49) MGAMKDM4EL3MBTL1TDP1ALOX15
SCHEMBL25239913 0.72 MGAM (0.52) MGAMKDM4EL3MBTL1TDP1ALOX15
SCHEMBL17802429 0.72 ALOX15 (0.39) MGAMKDM4EL3MBTL1TDP1ALOX15
SCHEMBL21383210 0.70 ALOX15 (0.49) MGAMKDM4ETDP1ALOX15TSHR
SCHEMBL21997620 0.69 MGAM (0.53) MGAMKDM4EL3MBTL1TDP1ALOX15
SCHEMBL22338015 0.69 CYP1A2 (0.45) KDM4EALOX15ALDH1A1HSD17B10KMT2A
SCHEMBL12405037 0.69 MGAM (0.63) MGAMKDM4EL3MBTL1TDP1ALOX15

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
US-12637468-B2 Substituted [1,2,4]triazolo[4,3-b]pyridazines as GABAA receptor modulators Shanghai Simr Biotechnology Co., Ltd. (CN) 2026-05-26 US disclosed
CN-114302886-B Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2024-03-22 CN disclosed
CN-114302886-A Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2022-04-08 CN disclosed
WO-2016041618-A1 SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES MERCK PATENT GMBH (DE) 2016-03-24 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-12637468-B2 Substituted [1,2,4]triazolo[4,3-b]pyridazines as GABAA receptor modulators GABRA6, GABRA1, GABRB1 MGAM 4856/4885KDM4E 3564/4885L3MBTL1 4704/4885

“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.