SCHEMBL3897351

SCHEMBL3897351

O=C1c2cccc(O)c2C(=O)c2c(F)ccc(F)c21

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.73
MAPT P10636 7/20 0.70
ALDH1A1 P00352 4/20 0.70
TDP1 Q9NUW8 4/20 0.70
TSHR P16473 3/20 0.70
MAPK1 P28482 3/20 0.70
HPGD P15428 3/20 0.70
ALOX15 P16050 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
HSD17B10 Q99714 3/20 0.70
LMNA P02545 2/20 0.70
MAOB P27338 2/20 0.70
HTT P42858 1/20 0.70
CSNK2A2 P19784 1/20 0.57
CSNK2B P67870 1/20 0.57
CSNK2A1 P68400 1/20 0.57
CSNK2A3 Q8NEV1 1/20 0.57
STAT3 P40763 2/20 0.56
KMT2A Q03164 6/20 0.53
KDM4E B2RXH2 5/20 0.53

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
SCHEMBL27660273 0.89 MAPT (0.77) MAOAMAPTALDH1A1TDP1TSHR
Anthrarufin SCHEMBL29363946 0.85 MAOA (1.00) MAOAMAPTALDH1A1TDP1TSHR
Anthrarufin SCHEMBL29874705 0.85 MAOA (1.00) MAOAMAPTALDH1A1TDP1TSHR
Anthrarufin SCHEMBL187843 0.85 MAOA (1.00) MAOAMAPTALDH1A1TDP1TSHR
SCHEMBL27680313 0.85 MAPT (0.61) MAOAMAPTALDH1A1TDP1TSHR
SCHEMBL30695844 0.84 MAOA (0.86) MAOAMAPTALDH1A1TDP1TSHR
SCHEMBL3198327 0.84 MAOA (0.86) MAOAMAPTALDH1A1TDP1TSHR
Danthron SCHEMBL29356886 0.83 MAPT (1.00) MAOAMAPTALDH1A1TDP1TSHR
Anthrarufin SCHEMBL28419741 0.83 MAOA (0.95) MAOAMAPTALDH1A1TDP1TSHR
Danthron SCHEMBL30544826 0.83 MAPT (1.00) MAOAMAPTALDH1A1TDP1TSHR

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-7557215-B2 Anthraquinone compounds as anti cancer compounds SOMANTA LIMITED (GB) 2009-07-07 US disclosed
EP-1701939-B1 ANTHRAQUINONE COMPOUNDS AS ANTI CANCER COMPOUNDS SOMANTA LTD (GB) 2009-02-25 EP disclosed
WO-2008062252-A1 N-OXIDES OF CYTOTOXIC ANTHRAQUINONES AS HYPOXIA-TARGETING PRODRUGS IN CANCER TREATMENT ACCESS PHARMACEUTICALS, INC (US) 2008-05-29 WO disclosed
US-20080027107-A1 Antharquinone Compounds as Anti Cancer Compounds SOMANTA LIMITED (GB) 2008-01-31 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-20080027107-A1 Antharquinone Compounds as Anti Cancer Compounds TOP2A, TOP2B, RECQL MAOA 3579/4885MAPT 4882/4885ALDH1A1 1484/4885

“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.