SCHEMBL19781133

SCHEMBL19781133

CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc5[nH]ncc5c4)cn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 2/20 0.48
GSK3B P49841 4/20 0.42
CDK5 Q00535 4/20 0.42
CDK1 P06493 3/20 0.42
PIM1 P11309 3/20 0.42
CDK2 P24941 3/20 0.42
GSK3A P49840 3/20 0.42
AURKB Q96GD4 2/20 0.42
CDK5R1 Q15078 2/20 0.42
ABL1 P00519 2/20 0.42
CCNT1 O60563 1/20 0.42
PGK1 P00558 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNA2 P20248 1/20 0.42
CSNK1E P49674 1/20 0.42
CDK9 P50750 1/20 0.42
JAK3 P52333 1/20 0.42
HASPIN Q8TF76 1/20 0.42
ROCK2 O75116 3/20 0.41
DYRK3 O43781 3/20 0.41

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
SCHEMBL19781802 0.85 DYRK1A (0.48) CDK5CDK2CDK5R1CCNT1CCNA2
SCHEMBL19781539 0.83 CLK1 (0.47) RIPK2DYRK1ACLK1KCNH2PIK3CA
SCHEMBL19781167 0.81 DYRK3 (0.51) RIPK2CDK5CDK2CDK5R1CCNT1
SCHEMBL19781131 0.81 CLK1 (0.41) CDK5CDK2CDK5R1ABL1CCNT1
SCHEMBL19781806 0.79 GRK5 (0.48) ABL1DYRK1ACLK1KCNH2PIK3CA
SCHEMBL19781810 0.78 KCNH2 (0.43) RIPK2DYRK1ACLK1KCNH2FDPS
SCHEMBL24460223 0.77 BCL2 (0.44) DYRK1AMAP4K4CLK1KCNH2PIK3CA
SCHEMBL19781168 0.77 SCN5A (0.50) RIPK2DYRK1ACLK1KCNH2PIK3CA
SCHEMBL19781553 0.77 SCN5A (0.50) RIPK2DYRK1ACLK1KCNH2PIK3CA
SCHEMBL19781776 0.77 FYN (0.54) RIPK2CLK1KCNH2PIK3CAMTOR

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 7 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-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
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-20230303569-A1 HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS C3AR1, C9, C1R RIPK2 2998/4885GSK3B 3181/4885CDK5 356/4885
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus C9, C1R, C1S RIPK2 2353/4885GSK3B 4217/4885CDK5 1085/4885
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus C9, C1R, C1S RIPK2 2353/4885GSK3B 4217/4885CDK5 1085/4885

“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.