SCHEMBL19781799

SCHEMBL19781799

CC(C)Oc1ccc(-c2cn3c(Br)cnc3cn2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
FYN P06241 11/20 0.47
WDR5 P61964 1/20 0.43
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
CHEK1 O14757 4/20 0.39
ADORA2A P29274 1/20 0.38
CHEK2 O96017 1/20 0.38
ABL1 P00519 1/20 0.38
GSK3B P49841 1/20 0.37

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
SCHEMBL19781541 0.85 FYN (0.64) CYP1A2FYNMKNK1MKNK2CHEK1
SCHEMBL19781261 0.83 CLK1 (0.47) CYP1A2WDR5TP53MAPT
SCHEMBL19243859 0.80 MKNK1 (0.48) FYNMKNK1MKNK2CHEK1GSK3B
SCHEMBL16304072 0.78 FYN (0.44) CYP1A2FYNMKNK1MKNK2CHEK1
SCHEMBL16304086 0.76 CHEK1 (0.45) FYNTP53MAPTMKNK1MKNK2
SCHEMBL19781580 0.76 FYN (0.57) CYP1A2FYNMKNK1MKNK2
SCHEMBL29394335 0.75 CHEK1 (0.61) FYNMKNK1MKNK2CHEK1GSK3B
SCHEMBL19781581 0.75 MAP4K4 (0.41) CYP1A2WDR5TP53MAPTMKNK2
SCHEMBL20203732 0.74 CYP1A2 (1.00) CYP1A2
SCHEMBL21835782 0.74 CYP1A2 (0.81) CYP1A2FYNWDR5TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220281825-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ARENAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2022-09-08 US disclosed
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus ARISAN THERAPEUTICS INC. (US) 2022-06-07 US disclosed
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus ARISAN THERAPEUTICS INC. (US) 2022-06-07 US disclosed
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-10-10 US disclosed
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-10-10 US disclosed
WO-2018013430-A2 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ARENAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2018-01-18 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-20220281825-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ARENAVIRUS INFECTION C9, C1S, ZC3HAV1 CYP1A2 1811/4885FYN 1794/4885WDR5 3258/4885
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus C9, C1R, C1S CYP1A2 1889/4885FYN 1982/4885WDR5 3465/4885
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus C9, C1R, C1S CYP1A2 1889/4885FYN 1982/4885WDR5 3465/4885

“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.