SCHEMBL19781137

SCHEMBL19781137

CC(C)Oc1ccc(-c2ccc3occ(-c4ccc(OC(C)C)cc4)c3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH2 P05091 2/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
GSK3B P49841 13/20 0.51
NPC1 O15118 3/20 0.51
POLB P06746 2/20 0.51
MEN1 O00255 2/20 0.51
MAPT P10636 2/20 0.51
RAB9A P51151 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
MAPK1 P28482 1/20 0.51
STAT1 P42224 1/20 0.51
CASP3 P42574 1/20 0.51
HTT P42858 1/20 0.51
HIF1A Q16665 1/20 0.51

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
SCHEMBL19781538 0.87 ALDH2 (0.49) ALDH2MAOAMAOBGSK3BNPC1
SCHEMBL19781149 0.84 ALDH2 (0.42) ALDH2MAOAMAOBGSK3BNPC1
SCHEMBL1310721 0.75 PTPN1 (0.55) GSK3BNPC1POLBRAB9ASMN1; SMN2
SCHEMBL197284 0.72 ALDH1A3 (0.56) POLBKMT2AALDH1A1GAA
SCHEMBL1143870 0.70 GSK3B (0.61) MAOAMAOBGSK3BNPC1POLB
SCHEMBL13464698 0.70 GSK3B (0.61) MAOAMAOBGSK3BNPC1POLB
SCHEMBL738941 0.70 ALDH2 (0.80) ALDH2MAOAMAOBNPC1POLB
SCHEMBL1701110 0.69 ALDH2 (1.00) ALDH2MAOAMAOBNPC1POLB
SCHEMBL24489673 0.69 NPC1 (0.49) GSK3BNPC1POLBRAB9ASMN1; SMN2
SCHEMBL11353246 0.69 POLB (0.49) GSK3BNPC1POLBMEN1MAPT

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-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
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 ALDH2 2344/4885MAOA 1233/4885MAOB 859/4885
US-11352328-B2 Heterocyclic compounds for the treatment of arenavirus C9, C1R, C1S ALDH2 2083/4885MAOA 957/4885MAOB 762/4885
US-20190308938-A1 Heterocyclic Compounds for the Treatment of Arenavirus C9, C1R, C1S ALDH2 2083/4885MAOA 957/4885MAOB 762/4885

“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.