SCHEMBL9436375

SCHEMBL9436375

Cc1nc(-c2ccc(O)cc2)sc1C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
KDM4E B2RXH2 2/20 0.49
GAA P10253 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
GLA P06280 1/20 0.49
MAPT P10636 1/20 0.49
AOC3 Q16853 2/20 0.47

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
Bromide SCHEMBL9195420 0.98 RAB9A (0.47) RAB9AKDM4EGAANPC1ALDH1A1
SCHEMBL4138997 0.83 KDM4E (0.58) RAB9AKDM4EGAAALDH1A1LMNA
SCHEMBL18725065 0.80 CASP3 (0.44) RAB9AKDM4EGAANPC1AOC3
SCHEMBL2095368 0.80 APP (0.51) LMNAAOC3
SCHEMBL1450948 0.80 RAB9A (0.60) RAB9AKDM4EGAANPC1ALDH1A1
SCHEMBL12641895 0.80 APP (0.51) RAB9AKDM4EGAANPC1ALDH1A1
SCHEMBL427731 0.79 SMN1; SMN2 (0.59) RAB9AKDM4EGAANPC1ALDH1A1
SCHEMBL27635289 0.79 ESR1 (0.37) GLAMAPTAOC3
SCHEMBL15130547 0.78 RAB9A (0.44) RAB9AKDM4EGAANPC1ALDH1A1
Hydrochloric Acid SCHEMBL3265116 0.78 SMN1; SMN2 (0.58) RAB9AKDM4EGAANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198220-A1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2021-07-01 US disclosed
US-11001563-B2 SSAO inhibitor SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2021-05-11 US disclosed
US-20200115352-A1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO., LTD. 2020-04-16 US disclosed
EP-3626699-A1 SSAO INHIBITOR Shandong Danhong Pharmaceutical Co., Ltd. (CN) 2020-03-25 EP disclosed
CN-1037268-C Antipicornaviral pyridazinamines JANSSEM PHARMACEUTICA N V (BE) 1998-02-04 CN disclosed
EP-0207453-B1 Heterocyclic substituted-phenoxyalkyl-isoxazoles and-furans, their preparation and use as antiviral agents STERLING WINTHROP INC (US) 1994-06-22 EP disclosed
US-5051437-A Treatment of rhinovirus or picornaviruses STERLING DRUG INC. (US) 1991-09-24 US disclosed
US-4857539-A Heterocyclic substituted-phenoxyalkylisoxazoles as antiviral useful agents STERLING DRUG INC. (US) 1989-08-15 US disclosed
EP-0207453-A2 Heterocyclic substituted-phenoxyalkyl-isoxazoles and-furans, their preparation and use as antiviral agents STERLING WINTHROP INC. (US) 1987-01-07 EP 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-11001563-B2 SSAO inhibitor SSB, ASAH2, AOX1 RAB9A 3567/4885KDM4E 2172/4885GAA 51/4885
US-20210198220-A1 SSAO INHIBITOR SSB, ASAH2, AOX1 RAB9A 3567/4885KDM4E 2172/4885GAA 51/4885
US-20200115352-A1 SSAO INHIBITOR SSB, ASAH2, AOX1 RAB9A 3567/4885KDM4E 2172/4885GAA 51/4885

“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.