SCHEMBL5216478

SCHEMBL5216478

O=Cc1ccc(OCc2ccccc2)c(OCc2ccccn2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KDM4E B2RXH2 2/20 0.58
TACR2 P21452 1/20 0.51
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
UBE2N P61088 1/20 0.50
HPGD P15428 2/20 0.49
CCR5 P51681 1/20 0.49
ABCB1 P08183 1/20 0.49
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
LMNA P02545 2/20 0.48
THRB P10828 1/20 0.48
HTT P42858 2/20 0.48
MAPT P10636 2/20 0.48
AMY1A P0DUB6 1/20 0.48
GSK3B P49841 1/20 0.48

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
SCHEMBL5217909 1.00 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL5215714 0.90 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL584489 0.87 TACR2 (0.62) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL29446267 0.87 TACR2 (0.62) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL15474905 0.86 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2KDM4EKMT2ALMNA
SCHEMBL1224760 0.86 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2KDM4EKMT2AHPGD
SCHEMBL29377794 0.82 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL161066 0.82 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2KDM4EKMT2AHPGD
SCHEMBL752160 0.82 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2KDM4ETACR2KMT2A
SCHEMBL15474548 0.81 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2KDM4EHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313471-B1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS UCB SA (BE) 2007-04-11 EP disclosed
US-7105554-B2 Benzylidene thiazolidinediones and their use as antimycotic agents OXFORD GLYCOSCIENCES (UK) LTD. (GB) 2006-09-12 US disclosed
US-20040006112-A1 Benzylidene thiazolidinediones and their use as antimycotic agents OXFORD GLYCOSCIENCES (UK) LTD (GB) 2004-01-08 US disclosed
EP-1313471-A1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS Oxford GlycoSciences (UK) Limited (GB) 2003-05-28 EP disclosed
WO-2002017915-A1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS OXFORD GLYCOSCIENCES (UK) LIMITED (GB) 2002-03-07 WO 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-20040006112-A1 Benzylidene thiazolidinediones and their use as antimycotic agents SLC5A2, OXSR1, SLC5A1 ALDH1A1 2757/4885SMN1; SMN2 4243/4885KDM4E 4012/4885

“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.