SCHEMBL385641

SCHEMBL385641

COc1ccc2s[c]cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.49
CYP1A2 P05177 4/20 0.45
CYP2A6 P11509 1/20 0.45
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41
CYP1A1 P04798 2/20 0.41
CYP1B1 Q16678 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B1 P14061 1/20 0.40

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
SCHEMBL533031 0.85 CYP1A2 (0.45) BACE1CYP1A2CYP2A6PDE3BPDE3A
SCHEMBL5535942 0.80 NQO1 (0.43) CYP1A2CA2CA12CA1CA7
SCHEMBL534326 0.77 ALOX15 (0.34) ALDH1A1CYP3A4MAPTMEN1KMT2A
SCHEMBL5534581 0.77 NPC1 (0.43) CYP1A2CYP3A4MAPTKMT2ACLK1
SCHEMBL1474219 0.76 ALDH1A1 (0.40) CA2CA12CA1CA7CA9
SCHEMBL443070 0.71 CYP1A2 (0.79) CYP1A2CYP2A6CA2CA12CA1
SCHEMBL29447161 0.71 CYP1A2 (0.79) CYP1A2CYP2A6CA2CA12CA1
SCHEMBL533196 0.71 AKR1C3 (0.32)
SCHEMBL16289860 0.70 MAPT (0.46) CA2CA12CA1CA7CA9
SCHEMBL533343 0.70 STING1 (0.38) ALDH1A1MEN1KMT2A

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115716849-A Synthetic method of aryl phosphorus compound 海南大学 2023-02-28 CN claimed
EP-3510026-B1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2020-08-12 EP claimed
EP-3510026-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS Janssen Pharmaceutica NV (BE) 2019-07-17 EP claimed
US-10000473-B2 Indazole derivatives useful as glucagon receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2018-06-19 US claimed
WO-2018048762-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2018-03-15 WO claimed
US-20180065955-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2018-03-08 US claimed
WO-2003028725-A1 4-(1-PIPERIDINY)-BUTYLCARBOXAMIDE AS D3 DOPAMINE RECEPTOR SUBTYPE SELECTIVE LIGANDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-04-10 WO claimed
US-5116986-A HETEROAROMATIC AMINE DERIVATIVES DR. KARL THOMAE GMBH (DE) 1992-05-26 US claimed
US-4912115-A Cardiovascular disorders DR. KARL THOMAE GMBH (DE) 1990-03-27 US claimed
CN-115716849-A Synthetic method of aryl phosphorus compound 海南大学 2023-02-28 CN disclosed
US-20200377462-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2020-12-03 US disclosed
US-10774048-B2 Indazole derivatives useful as glucagon receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2020-09-15 US disclosed
EP-3510026-B1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2020-08-12 EP disclosed
EP-3510028-B1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2020-08-05 EP disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP disclosed
CN-1287117-A Cyclobutene derivatives, preparation method and therapeutic use thereof SANKYO CO (JP) 2001-03-14 CN disclosed
EP-1070703-A1 Cyclobutene derivatives Sankyo Company Limited (JP) 2001-01-24 EP disclosed
US-5175157-A Cardiovascular disorders BOEHRINGER INGELHEIM GMBH (DE) 1992-12-29 US disclosed
US-5116986-A HETEROAROMATIC AMINE DERIVATIVES DR. KARL THOMAE GMBH (DE) 1992-05-26 US disclosed
US-4912115-A Cardiovascular disorders DR. KARL THOMAE GMBH (DE) 1990-03-27 US 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-10774048-B2 Indazole derivatives useful as glucagon receptor antagonists GPR119, GLP1R, GIPR BACE1 2338/4885CYP1A2 296/4885CYP2A6 917/4885
US-20200377462-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS GPR119, GLP1R, GIPR BACE1 2338/4885CYP1A2 296/4885CYP2A6 917/4885
US-20180065955-A1 INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS GPR119, GLP1R, GIPR BACE1 2338/4885CYP1A2 296/4885CYP2A6 917/4885
US-10000473-B2 Indazole derivatives useful as glucagon receptor antagonists GPR119, GLP1R, GIPR BACE1 2338/4885CYP1A2 296/4885CYP2A6 917/4885

“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.