SCHEMBL4591470

SCHEMBL4591470

CC(=O)c1cc(Cl)c(Cl)cc1N

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.44
GAA P10253 3/20 0.42
ABL1 P00519 1/20 0.40
CD44 P16070 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
CYP3A4 P08684 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
RECQL P46063 1/20 0.35
MAPK1 P28482 1/20 0.35
BRD4 O60885 1/20 0.35
KDM4E B2RXH2 1/20 0.34
NQO2 P16083 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
SCHEMBL30818918 1.00 SLC9A1 (0.44) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL10744416 0.89 GAA (0.52) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL30515968 0.85 CD44 (0.56) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL17030863 0.85 CD44 (0.56) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL16636823 0.84 SLC9A1 (0.40) SLC9A1GAAABL1SMN1; SMN2CYP3A4
SCHEMBL16637172 0.84 CFTR (0.38) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL21232254 0.84 FADS1 (0.42) SLC9A1GAAABL1CD44SMN1; SMN2
SCHEMBL30390446 0.84 SLC9A1 (0.40) SLC9A1GAAABL1SMN1; SMN2CYP3A4
SCHEMBL24010000 0.81 GAA (0.58) GAASMN1; SMN2CYP3A4ALDH1A1KDM4E
SCHEMBL10742310 0.81 ABL1 (0.34) SLC9A1GAAABL1CD44SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166624-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. 2024-05-23 US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
EP-4301734-A1 PPARG INVERSE AGONISTS AND USES THEREOF Flare Therapeutics Inc. (US) 2024-01-10 EP disclosed
WO-2023278816-A1 HETEROCYCLIC ALDEHYDE TRAPPING COMPOUNDS AND USES THEREOF ALDEYRA THERAPEUTICS, INC. (US) 2023-01-05 WO disclosed
WO-2022187203-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS, INC. (US) 2022-09-09 WO disclosed
US-7348332-B2 (3,4-dihydro-quinazolin-2-yl)-indan-1-yl-amines HOFFMANN-LA ROCHSE INC. (US) 2008-03-25 US disclosed
EP-1871748-A1 (3,4-DIHYDRO-QUINAZOLIN-2-YL)-INDAN-1-YL-AMINES F. Hoffmann-Roche AG (CH) 2008-01-02 EP disclosed
WO-2006108773-A1 (3,4-DIHYDRO-QUINAZOLIN-2-YL)-INDAN-1-YL-AMINES F. HOFFMANN-LA ROCHE AG (CH) 2006-10-19 WO disclosed
US-20060229323-A1 (3,4-Dihydro-quinazolin-2-yl)-indan-1-yl-amines F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 US disclosed
EP-0760819-B1 TRICYCLIC DICARBONYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2000-07-19 EP disclosed
CN-1044245-C Tricyclic Dicarbonyl derivatives HAFFMANN LA ROCHE AG F (DE) 1999-07-21 CN disclosed
US-5688803-A BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS HOFFMANN-LA ROCHE INC. (US) 1997-11-18 US disclosed
CN-1149295-A Tricyclic Dicarbonyl derivatives HOFFMANN LA ROCHE (CH) 1997-05-07 CN disclosed
EP-0760819-A1 TRICYCLIC DICARBONYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-03-12 EP disclosed
WO-1995032205-A1 TRICYCLIC DICARBONYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1995-11-30 WO disclosed
US-4379929-A BACTERIOSTATS ELI LILLY AND COMPANY (US) 1983-04-12 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 (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-20240166624-A1 PPARG INVERSE AGONISTS AND USES THEREOF PPARG, PPARA, PPARD SLC9A1 2107/4885GAA 2448/4885ABL1 3094/4885
US-20060229323-A1 (3,4-Dihydro-quinazolin-2-yl)-indan-1-yl-amines HTR5A, HTR1A, HTR1E SLC9A1 517/4885GAA 2472/4885ABL1 542/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS SLC9A1 2755/4885GAA 27/4885ABL1 407/4885

“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.