SCHEMBL2999222

SCHEMBL2999222

O=[N+]([O-])c1cc(CN2CCS(=O)(=O)CC2)cc2cc(-c3ccccc3)[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.39
CYP19A1 P11511 1/20 0.38
RAB9A P51151 2/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPK1 P28482 3/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
NPY5R Q15761 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
FBP1 P09467 1/20 0.36
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36
VCP P55072 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL22806920 0.86 KDM4E (0.45) CYP19A1RAB9AGAAL3MBTL1MAPK1
SCHEMBL3433366 0.83 JAK1 (0.40) DHODHLMNANPY5RMEN1KMT2A
SCHEMBL29384916 0.83 JAK1 (0.40) DHODHLMNANPY5RMEN1KMT2A
SCHEMBL17865581 0.81 FBP1 (0.57) DHODHPOLBMEN1KMT2AFBP1
SCHEMBL3415905 0.79 DHODH (0.36) DHODHRAB9AGAAL3MBTL1MAPK1
SCHEMBL22807011 0.78 HRH4 (0.42) CYP19A1GAAL3MBTL1MAPK1LMNA
SCHEMBL22806895 0.77 CYP19A1 (0.46) DHODHCYP19A1RAB9APOLBNPY5R
SCHEMBL3008832 0.77 CYP19A1 (0.46) DHODHCYP19A1POLBMEN1KMT2A
SCHEMBL2995350 0.77 CYP19A1 (0.46) DHODHCYP19A1RAB9APOLBNPY5R
SCHEMBL1897623 0.76 CSF1R (0.42) DHODHRAB9AGAAMAPK1NPY5R

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114080382-B Process for preparing indole or indazole compounds 株式会社LG化学 2024-05-24 CN claimed
EP-3971184-B1 METHOD FOR PREPARING INDOLE OR INDAZOLE COMPOUND LG CHEMICAL LTD (KR) 2024-04-03 EP claimed
EP-3971184-A1 METHOD FOR PREPARING INDOLE OR INDAZOLE COMPOUND LG Chem, Ltd. (KR) 2022-03-23 EP claimed
CN-114080382-A Process for preparing indole or indazole compounds 株式会社LG化学 2022-02-22 CN claimed
CN-114080386-B Process for preparing indole or indazole compounds 株式会社LG化学 2024-05-31 CN disclosed
CN-114080382-B Process for preparing indole or indazole compounds 株式会社LG化学 2024-05-24 CN disclosed
EP-3971185-B1 METHOD FOR PREPARING INDOLE OR INDAZOLE COMPOUND LG CHEMICAL LTD (KR) 2024-04-17 EP disclosed
EP-3971184-B1 METHOD FOR PREPARING INDOLE OR INDAZOLE COMPOUND LG CHEMICAL LTD (KR) 2024-04-03 EP disclosed
CN-114096534-B Process for preparing indole or indazole compounds 株式会社LG化学 2024-01-02 CN disclosed
EP-3971186-B1 PREPARATION METHOD FOR INDOLE OR INDAZOLE COMPOUND LG CHEMICAL LTD (KR) 2023-08-02 EP disclosed
EP-3971186-A1 PREPARATION METHOD FOR INDOLE OR INDAZOLE COMPOUND LG Chem, Ltd. (KR) 2022-03-23 EP disclosed
EP-3971185-A1 METHOD FOR PREPARING INDOLE OR INDAZOLE COMPOUND LG Chem, Ltd. (KR) 2022-03-23 EP disclosed
US-8349885-B2 Indole and indazole derivatives having a cell-, tissue- and organ-preserving effect LG LIFE SCIENCES LTD. (KR) 2013-01-08 US disclosed
US-20120270203-A1 INDOLE AND INDAZOLE DERIVATIVES HAVING A CELL-, TISSUE- AND ORGAN-PRESERVING EFFECT LG CHEM, LTD. (KR) 2012-10-25 US disclosed
US-20100291533-A1 INDOLE AND INDAZOLE DERIVATIVES HAVING A CELL-, TISSUE- AND ORGAN-PRESERVING EFFECT LG LIFE SCIENCES LTD. (KR) 2010-11-18 US disclosed
EP-2230238-A2 INDOLE AND INDAZOLE DERIVATIVES HAVING A CELL-, TISSUE- AND ORGAN-PRESERVING EFFECT LG Life Sciences Ltd. (KR) 2010-09-22 EP disclosed
US-20100197673-A1 INDOLE AND INDAZOLE COMPOUNDS AS AN INHIBITOR OF CELLULAR NECROSIS LG LIFE SCIENCES LTD (KR) 2010-08-05 US disclosed
CN-101784543-A Indole and indazole compounds as inhibitors of cellular necrosis LG LIFE SCIENCES LTD 2010-07-21 CN disclosed
EP-2178870-A1 INDOLE AND INDAZOLE COMPOUNDS AS AN INHIBITOR OF CELLULAR NECROSIS LG Life Sciences Ltd. (KR) 2010-04-28 EP disclosed
WO-2009025478-A1 INDOLE AND INDAZOLE COMPOUNDS AS AN INHIBITOR OF CELLULAR NECROSIS LG LIFE SCIENCES LTD. (KR) 2009-02-26 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 (3 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-20120270203-A1 INDOLE AND INDAZOLE DERIVATIVES HAVING A CELL-, TISSUE- AND ORGAN-PRESERVING EFFECT IDO1, IDO2, INMT DHODH 2870/4885CYP19A1 969/4885RAB9A 3325/4885
US-20100197673-A1 INDOLE AND INDAZOLE COMPOUNDS AS AN INHIBITOR OF CELLULAR NECROSIS IDO1, IDO2, NFATC1 DHODH 1097/4885CYP19A1 2038/4885RAB9A 3616/4885
US-20100291533-A1 INDOLE AND INDAZOLE DERIVATIVES HAVING A CELL-, TISSUE- AND ORGAN-PRESERVING EFFECT IDO1, IDO2, INMT DHODH 2870/4885CYP19A1 969/4885RAB9A 3325/4885

“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.