SCHEMBL16745356

SCHEMBL16745356

O=c1c2sc3c(=O)c4c(O)cccc4c(=O)c3c2c(=O)c2cccc(O)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.49
EGFR P00533 1/20 0.47
MAPT P10636 3/20 0.45
HTT P42858 2/20 0.45
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
ALOX15 P16050 2/20 0.43
TSHR P16473 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
APP P05067 1/20 0.43
THRB P10828 1/20 0.43
CASP1 P29466 1/20 0.43
SNCA P37840 1/20 0.43
RECQL P46063 1/20 0.43
DPP3 Q9NY33 1/20 0.43
MAOB P27338 2/20 0.40
KDM5A P29375 1/20 0.39
ATP1A1 P05023 1/20 0.38
ATP1B1 P05026 1/20 0.38
ATP1A3 P13637 1/20 0.38

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
SCHEMBL16745367 0.96 MAOA (0.46) MAOAEGFRMAPTHTTHPGD
SCHEMBL16745364 0.95 MAOA (0.49) MAOAEGFRMAPTHTTHPGD
SCHEMBL16745354 0.92 MAOA (0.44) MAOAEGFRMAPTHTTHPGD
SCHEMBL16745351 0.91 MAOA (0.49) MAOAEGFRMAPTHTTHPGD
SCHEMBL18193066 0.87 DPP3 (0.45) MAOAEGFRMAPTHTTHPGD
SCHEMBL25468883 0.81 MAOA (0.57) MAOAEGFRMAPTHTTHPGD
SCHEMBL30342267 0.81 MAOA (0.57) MAOAEGFRMAPTHTTHPGD
SCHEMBL8835986 0.77 MAPT (0.52) MAOAEGFRMAPTHTTHPGD
SCHEMBL6254791 0.77 MAPT (0.52) MAOAEGFRMAPTHTTHPGD
SCHEMBL16745341 0.77 ALDH1A1 (0.44) MAPTHPGDHSD17B10TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9481662-B2 Seriniquinones, melanoma-specific anticancer agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-01 US disclosed
US-9481662-B2 Seriniquinones, melanoma-specific anticancer agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-01 US disclosed
US-20150148314-A1 SERINIQUINONES, MELANOMA-SPECIFIC ANTICANCER AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-28 US disclosed
US-20150148314-A1 SERINIQUINONES, MELANOMA-SPECIFIC ANTICANCER AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-28 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-20150148314-A1 SERINIQUINONES, MELANOMA-SPECIFIC ANTICANCER AGENTS SDHA, KLK3, BRDT MAOA 990/4885EGFR 3504/4885MAPT 3301/4885

“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.