SCHEMBL9972399

SCHEMBL9972399

Cc1cc2c(N)cccc2nc1Nc1cc(C(F)(F)F)ccn1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 1/20 0.41
SYK P43405 4/20 0.41
NOS3 P29474 1/20 0.40
NOS2 P35228 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ABCG2 Q9UNQ0 3/20 0.38
AURKA O14965 3/20 0.37
MAP3K12 Q12852 1/20 0.37
EGFR P00533 1/20 0.37
APP P05067 1/20 0.37
RPS6KB1 P23443 1/20 0.37
THRB P10828 1/20 0.37
TEAD1 P28347 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.36

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
SCHEMBL9965286 0.83 SYK (0.42) IDH2SYKNOS3NOS2ALDH1A1
SCHEMBL17443159 0.82 IDH2 (0.45) IDH2SYKNOS3NOS2ALDH1A1
SCHEMBL22135110 0.81 IDH2 (0.38) IDH2SYKALDH1A1GAAL3MBTL1
SCHEMBL9939354 0.81 MAPK10 (0.44) IDH2SYKALDH1A1GAAL3MBTL1
SCHEMBL9938726 0.80 SYK (0.40) IDH2SYKNOS3NOS2ALDH1A1
SCHEMBL9943489 0.79 CLK1 (0.40) IDH2SYKALDH1A1GAAL3MBTL1
SCHEMBL9965323 0.76 KDM4E (0.41) NOS3NOS2ALDH1A1GAAEGFR
SCHEMBL25854032 0.73 CRHR1 (0.38) ALDH1A1GAA
SCHEMBL904195 0.70 SYK (0.52) IDH2SYKALDH1A1GAAL3MBTL1
SCHEMBL25894573 0.69 SYK (0.38) IDH2SYKALDH1A1GAAL3MBTL1

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
WO-2023139233-A1 COMBINATION OF 8-CHLORO-N-(4-(TRIFLUOROMETHOXY)PHENYL)QUINOLIN-2-AMINE AND ITS DERIVATIVES WITH A JAK INHIBITOR ABIVAX (FR) 2023-07-27 WO disclosed
EP-4215196-A1 COMBINATION OF 8-CHLORO-N-(4-(TRIFLUOROMETHOXY)PHENYL)QUINOLIN-2-AMINE AND ITS DERIVATIVES WITH A JAK INHIBITOR ABIVAX (FR) 2023-07-26 EP disclosed
WO-2023135207-A1 COMBINATION OF 8-CHLORO-N-(4-(TRIFLUOROMETHOXY)PHENYL)QUINOLIN-2-AMINE AND ITS DERIVATIVES WITH A S1P RECEPTOR MODULATOR ABIVAX (FR) 2023-07-20 WO disclosed
EP-4212156-A1 COMBINATION OF 8-CHLORO-N-(4-(TRIFLUOROMETHOXY)PHENYL)QUINOLIN-2-AMINE AND ITS DERIVATIVES WITH A S1P RECEPTOR MODULATOR ABIVAX (FR) 2023-07-19 EP disclosed
US-20220145406-A1 BIOMARKERS, AND USES IN TREATMENT OF VIRAL INFECTIONS, INFLAMMATIONS, OR CANCER ABIVAX (FR) 2022-05-12 US disclosed
US-20220023324-A1 QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF INFLAMMATION DISEASES ABIVAX (FR) 2022-01-27 US disclosed
WO-2020127843-A1 QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF INFLAMMATION DISEASES ABIVAX (FR) 2020-06-25 WO disclosed
WO-2020127853-A1 BIOMARKERS, AND USES IN TREATMENT OF VIRAL INFECTIONS, INFLAMMATIONS, OR CANCER ABIVAX (FR) 2020-06-25 WO disclosed
WO-2020127839-A1 QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OR PREVENTION OF CANCER ABIVAX (FR) 2020-06-25 WO disclosed
EP-3669874-A1 QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OR PREVENTION OF CANCER ABIVAX (FR) 2020-06-24 EP disclosed
EP-3670659-A1 BIOMARKERS, AND USES IN TREATMENT OF VIRAL INFECTIONS, INFLAMMATIONS, OR CANCER ABIVAX (FR) 2020-06-24 EP disclosed
EP-3669873-A1 QUINOLINE DERIVATIVES FOR USE INE THE TRAEATMENT OF INFLAMMATION DISEASES ABIVAX (FR) 2020-06-24 EP disclosed
US-9061999-B2 Compounds useful for treating AIDS ABIVAX (FR) 2015-06-23 US disclosed
US-9061999-B2 Compounds useful for treating AIDS ABIVAX (FR) 2015-06-23 US disclosed
US-20130267703-A1 COMPOUNDS USEFUL FOR TREATING AIDS SPLICOS (FR) 2013-10-10 US disclosed
US-20130267703-A1 COMPOUNDS USEFUL FOR TREATING AIDS SPLICOS (FR) 2013-10-10 US disclosed
EP-2465502-A1 Compounds useful for treating AIDS Société Splicos (FR) 2012-06-20 EP 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-20130267703-A1 COMPOUNDS USEFUL FOR TREATING AIDS CBR3, CBR1, CCR10 IDH2 549/4885SYK 1956/4885NOS3 30/4885
US-20220023324-A1 QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF INFLAMMATION DISEASES NR1H3, NR1H2, NR1H4 IDH2 823/4885SYK 1176/4885NOS3 25/4885
US-20220145406-A1 BIOMARKERS, AND USES IN TREATMENT OF VIRAL INFECTIONS, INFLAMMATIONS, OR CANCER HAVCR2, CXCL8, IL36G IDH2 1088/4885SYK 2246/4885NOS3 2445/4885

“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.