SCHEMBL25336685

SCHEMBL25336685

Nc1ccc(-c2ccnc(Nc3ccc(C(F)(F)F)cc3)n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 5/20 0.63
SYK P43405 2/20 0.60
KCNH2 Q12809 1/20 0.57
SCN9A Q15858 1/20 0.57
CHUK O15111 1/20 0.57
CDK2 P24941 3/20 0.56
ABL1 P00519 1/20 0.52
BCR P11274 1/20 0.52
SRC P12931 1/20 0.52
PIK3CA P42336 3/20 0.51
PIK3CB P42338 3/20 0.51
PIK3CG P48736 3/20 0.51
AURKA O14965 1/20 0.50
CDK1 P06493 1/20 0.50
CDK4 P11802 1/20 0.50
CDK7 P50613 1/20 0.50
CDK9 P50750 1/20 0.50
PLK1 P53350 1/20 0.50
GSK3B P49841 1/20 0.49
CAMK2D Q13557 1/20 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
SCHEMBL31119043 1.00 IKBKB (0.63) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL3521444 0.86 CAMK2D (0.63) IKBKBSYKCHUKCDK2ABL1
SCHEMBL30554478 0.85 PLK1 (0.72) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL25337631 0.85 PLK1 (0.72) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL4903317 0.84 ABL1 (0.70) IKBKBSCN9ACDK2ABL1BCR
SCHEMBL3518043 0.84 IKBKB (0.74) IKBKBCHUKCDK2CDK1CDK7
SCHEMBL25337250 0.83 PLK1 (0.53) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL25338138 0.83 PIK3CA (0.55) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL31118851 0.83 PIK3CA (0.55) IKBKBSYKKCNH2SCN9ACHUK
SCHEMBL30554560 0.83 PLK1 (0.53) IKBKBSYKKCNH2SCN9ACHUK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260022099-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2026-01-22 US disclosed
US-12371408-B2 Aryl hydrocarbon receptor agonists and uses thereof NEXYS THERAPEUTICS, INC. (US) 2025-07-29 US disclosed
US-12168646-B2 Aryl hydrocarbon receptor agonists and uses thereof NEXYS THERAPEUTICS, INC. (US) 2024-12-17 US disclosed
EP-4472953-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF Nexys Therapeutics, Inc. (US) 2024-12-11 EP disclosed
US-20240279185-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2024-08-22 US disclosed
US-20240208913-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2024-06-27 US disclosed
US-20240208913-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2024-06-27 US disclosed
WO-2023150197-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2023-08-10 WO disclosed
WO-2023150197-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF NEXYS THERAPEUTICS, INC. (US) 2023-08-10 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 (5 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-12371408-B2 Aryl hydrocarbon receptor agonists and uses thereof AHR, ARNT, NR1H2 IKBKB 639/4885SYK 3388/4885KCNH2 3265/4885
US-20260022099-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF AHR, NR1H4, CNR1 IKBKB 1226/4885SYK 3947/4885KCNH2 2096/4885
US-20240279185-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF AHR, ARNT, NR1H2 IKBKB 639/4885SYK 3388/4885KCNH2 3265/4885
US-12168646-B2 Aryl hydrocarbon receptor agonists and uses thereof AHR, ARNT, NR1H2 IKBKB 639/4885SYK 3388/4885KCNH2 3265/4885
US-20240208913-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF AHR, ARNT, NR1H2 IKBKB 639/4885SYK 3388/4885KCNH2 3265/4885

“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.