SCHEMBL3131684

SCHEMBL3131684

COc1ccc2nn(-c3ccccc3)cc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.60
RAB9A P51151 6/20 0.50
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
NPC1 O15118 4/20 0.50
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 1/20 0.50
NLRP3 Q96P20 1/20 0.50
ADORA3 P0DMS8 5/20 0.49
ADORA1 P30542 3/20 0.49
ADORA2A P29274 2/20 0.49
MAPK1 P28482 2/20 0.49
HTT P42858 2/20 0.49
HPGD P15428 1/20 0.49
MAPK10 P53779 1/20 0.49
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
LMNA P02545 2/20 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
SCHEMBL28803989 0.88 RAB9A (0.58) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL28792823 0.86 MEN1 (0.50) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL9109376 0.86 MAOB (0.52) ESR2RAB9ANPC1SMN1; SMN2ADORA3
SCHEMBL9114545 0.85 ESR2 (0.57) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL17731528 0.84 CYP11B2 (0.49) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL29472984 0.81 ADORA1 (0.59) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL28541224 0.81 ADORA1 (0.59) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL1872760 0.81 HTT (0.57) RAB9AMEN1KMT2ANPC1ALDH1A1
SCHEMBL11685099 0.79 ESR2 (0.54) ESR2RAB9AMEN1KMT2ANPC1
SCHEMBL28539726 0.79 NPC1 (0.52) ESR2RAB9AMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184598-A Photocatalytic preparation method and application of N- (2-phenyl-2H-indazole-3-yl) benzamide compound 河南师范大学 2024-06-14 CN disclosed
CN-113698349-B Aqueous phase photocatalysis preparation method of 2- (2-phenyl-2H-indazole-3-yl) acetate compound 河南师范大学 2023-08-01 CN disclosed
CN-116332851-A Cyanomethyl phenyl indazole compound and preparation method thereof 河南中医药大学 2023-06-27 CN disclosed
CN-115613060-A Method for synthesizing C-3 phosphorylated 2H-indazole compound by direct electrochemical oxidation 浙江工业大学 2023-01-17 CN disclosed
CN-114989089-A Photocatalytic preparation method of 3-alkyl-2-phenyl indazole compound 河南师范大学 2022-09-02 CN disclosed
CN-114805209-A Preparation method of visible light induced 3-aryl-2H-indazole compound 河南工程学院 2022-07-29 CN disclosed
CN-113698349-A Water-phase photocatalytic preparation method of 2- (2-phenyl-2H-indazole-3-yl) acetate compounds 河南师范大学 2021-11-26 CN disclosed
US-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 US disclosed
EP-1899309-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2008-03-19 EP disclosed
WO-2007003419-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2007-01-11 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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR ESR2 270/4885RAB9A 3355/4885MEN1 496/4885

“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.