SCHEMBL2993745

SCHEMBL2993745

Cc1cc2ccc(F)cc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.52
NFE2L2 Q16236 1/20 0.52
DAO P14920 1/20 0.52
DDO Q99489 1/20 0.52
AHR P35869 2/20 0.47
ITK Q08881 2/20 0.45
CYP2A6 P11509 2/20 0.44
FLT3 P36888 2/20 0.42
KDM4E B2RXH2 1/20 0.42
AXL P30530 1/20 0.41
KIF11 P52732 1/20 0.39
AKR1B1 P15121 1/20 0.39
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CCNA1 P78396 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL20615410 0.84 TNKS2 (0.50) KEAP1NFE2L2DAODDOITK
SCHEMBL12433 0.83 KEAP1 (0.59) KEAP1NFE2L2DAOAHRCYP2A6
SCHEMBL4568030 0.78 DAO (0.47) KEAP1NFE2L2DAODDOAHR
SCHEMBL29993172 0.77 DAO (0.55) DAODDOAHRITKCYP2A6
SCHEMBL30807019 0.77 DAO (0.55) KEAP1DAODDOITKCYP2A6
SCHEMBL890079 0.77 DAO (0.55) KEAP1DAODDOITKCYP2A6
SCHEMBL12970589 0.76 DAO (0.64) KEAP1NFE2L2DAODDOAHR
SCHEMBL475358 0.74 LMNA (0.52) KEAP1AHRITKCYP2A6AXL
SCHEMBL394630 0.74 CYP2A6 (0.70) KEAP1CYP2A6KDM4EAXLMEN1
SCHEMBL8529940 0.74 CYP2A6 (0.44) KEAP1DAODDOCYP2A6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1829872-B1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2015-07-29 EP claimed
CN-101468964-B Processes for producing indole compound NISSAN CHEMICAL IND LTD 2011-05-11 CN claimed
CN-100577659-C Processes for producing indole compound NISSAN CHEMICAL IND LTD 2010-01-06 CN claimed
CN-101468964-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2009-07-01 CN claimed
EP-1829872-A1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS Nissan Chemical Industries, Ltd. (JP) 2007-09-05 EP claimed
CN-1896075-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2007-01-17 CN claimed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN claimed
US-20250263760-A1 MODIFIED BACTERIA FOR PRODUCTION OF NITROAROMATICS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2025-08-21 US disclosed
US-12319946-B2 Methods for producing modified bacteria for production of nitroaromatics UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2025-06-03 US disclosed
US-20250092036-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING THE ACTIVITY OF ERK NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2025-03-20 US disclosed
WO-2025037229-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING THE ACTIVITY OF ERK NOVARTIS AG (CH) 2025-02-20 WO disclosed
US-20240229090-A1 MODIFIED BACTERIA FOR PRODUCTION OF NITROAROMATICS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-07-11 US disclosed
US-20240229090-A1 MODIFIED BACTERIA FOR PRODUCTION OF NITROAROMATICS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-07-11 US disclosed
US-20070083053-A1 Process for producing indole compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-12 US disclosed
CN-1896075-A Processes for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2007-01-17 CN disclosed
CN-1286832-C Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2006-11-29 CN disclosed
WO-2006107784-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2006-10-12 WO disclosed
CN-1646522-A Process for producing indole compound NISSAN CHEMICAL IND LTD (JP) 2005-07-27 CN disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US 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-20250092036-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING THE ACTIVITY OF ERK MAPK1, MAP3K1, MAPK6 KEAP1 221/4885NFE2L2 229/4885DAO 4622/4885
US-20070083053-A1 Process for producing indole compound IDO2, IDO1, TDO2 KEAP1 2159/4885NFE2L2 484/4885DAO 105/4885

“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.