SCHEMBL19781609

SCHEMBL19781609

CC(C)Oc1ccc(-c2cnc3ccc(Br)cn23)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.51
MTOR P42345 3/20 0.51
MAP3K14 Q99558 1/20 0.45
CYP1A2 P05177 1/20 0.43
FYN P06241 5/20 0.42
CLK1 P49759 2/20 0.41
DYRK1A Q13627 1/20 0.41
RIPK2 O43353 1/20 0.39
WDR5 P61964 1/20 0.39
KCNH2 Q12809 1/20 0.38
FLT3 P36888 4/20 0.38

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
SCHEMBL19781539 0.89 CLK1 (0.47) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL26361714 0.86 FLT3 (0.46) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL21436049 0.84 MAPT (0.43) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL3854288 0.84 PIK3CA (0.65) PIK3CAMTORMAP3K14FYNCLK1
SCHEMBL22032850 0.83 FLT3 (0.43) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL24460223 0.83 BCL2 (0.44) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL19781776 0.83 FYN (0.54) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL19781553 0.83 SCN5A (0.50) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL19781168 0.83 SCN5A (0.50) PIK3CAMTORCYP1A2FYNCLK1
SCHEMBL19781775 0.83 FLT3 (0.51) PIK3CAMTORCYP1A2FYNCLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2023-09-28 US disclosed
US-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2023-09-28 US disclosed
US-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2023-09-28 US disclosed
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
WO-2022108849-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2022-05-27 WO disclosed
WO-2022108849-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS ARISAN THERAPEUTICS INC. (US) 2022-05-27 WO 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 (4 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 PIK3CA 4245/4885MTOR 3138/4885MAP3K14 3911/4885
US-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS C3AR1, C9, C1R PIK3CA 1740/4885MTOR 679/4885MAP3K14 3491/4885
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus C9, C1R, C1S PIK3CA 4298/4885MTOR 3265/4885MAP3K14 4033/4885
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus C9, C1R, C1S PIK3CA 4298/4885MTOR 3265/4885MAP3K14 4033/4885

“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.