SCHEMBL5866546

SCHEMBL5866546

O=C1c2ccccc2-c2[nH]c3ccccc3c(=O)c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.59
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 5/20 0.55
GAA P10253 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 3/20 0.55
GLA P06280 2/20 0.55
HTT P42858 2/20 0.55
HPGD P15428 2/20 0.55
ATM Q13315 1/20 0.55
PTPRC P08575 1/20 0.48
POLB P06746 6/20 0.46
TDP1 Q9NUW8 4/20 0.46
RAB9A P51151 2/20 0.44
APAF1 O14727 1/20 0.44
PAX8 Q06710 1/20 0.44
HSD17B10 Q99714 3/20 0.43
SRC P12931 1/20 0.43
CTRB1 P17538 1/20 0.43
CCNE1 P24864 1/20 0.43

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
SCHEMBL6503650 0.89 MAOA (0.54) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL30673946 0.89 MAOA (0.54) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL125196 0.84 ALDH1A1 (0.64) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL29374815 0.84 ALDH1A1 (0.64) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL29518344 0.84 ALDH1A1 (0.64) MAOAALDH1A1KDM4EGAASMN1; SMN2
Benzocarbazoledione SCHEMBL22541347 0.81 MAOA (0.54) MAOAALDH1A1KDM4EGAASMN1; SMN2
Anthraquinone SCHEMBL2778403 0.80 ALDH1A1 (0.78) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL4053013 0.77 PTPRC (0.54) MAOAALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL30480799 0.77 PTPRC (0.54) MAOAALDH1A1KDM4EGAASMN1; SMN2
Anthraquinone SCHEMBL1900459 0.76 ALDH1A1 (0.67) MAOAALDH1A1KDM4EGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109338-B2 For use in the prophylaxis and the treatment of Picornavirus and human rotavirus infections. MARUISHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-19 US disclosed
US-20040009977-A1 1,2-disubstituted 1,4-dihydro-4-oxoquinoline compounds MARUISHI PHARMACEUTICAL CO., LTD. (JP) 2004-01-15 US disclosed
US-6541470-B1 Have a potent antiviral activity against picornaviruses and rotaviruses. MARUISHI PHARMACEUTICAL CO., LTD. (JP) 2003-04-01 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 (1 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-20040009977-A1 1,2-disubstituted 1,4-dihydro-4-oxoquinoline compounds MAVS, IRF3, EIF2AK2 MAOA 1781/4885ALDH1A1 1671/4885KDM4E 635/4885

“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.