SCHEMBL7035247

SCHEMBL7035247

O=C(Nc1ccc(-c2ccsc2)cc1C(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.51
SERPINE1 P05121 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ACMSD Q8TDX5 1/20 0.49
NR1H4 Q96RI1 4/20 0.48
SLC16A3 O15427 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
IGF2BP2 Q9Y6M1 1/20 0.47
PPARG P37231 3/20 0.46
PPARA Q07869 1/20 0.46
PTPN1 P18031 1/20 0.45
DEGS1 O15121 1/20 0.45
HDAC1 Q13547 2/20 0.45
SIRT2 Q8IXJ6 1/20 0.45

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
SCHEMBL7038969 0.99 DHODH (0.50) DHODHSERPINE1KDM4EACMSDNR1H4
Lithium Ion SCHEMBL7038967 0.89 PPARG (0.60) DHODHSERPINE1NR1H4NPC1RAB9A
SCHEMBL7041709 0.88 PLAU (0.52) DHODHKDM4ENR1H4NPC1RAB9A
SCHEMBL7039996 0.81 DEGS1 (0.62) KDM4ENR1H4NPC1RAB9APTPN1
SCHEMBL7038115 0.81 IGF2BP2 (0.50) SERPINE1ACMSDNR1H4NPC1RAB9A
SCHEMBL7038149 0.80 IGF2BP2 (0.49) SERPINE1ACMSDNR1H4NPC1RAB9A
SCHEMBL7033993 0.79 NR1H4 (0.53) DHODHSERPINE1KDM4EACMSDNR1H4
SCHEMBL7039689 0.78 MAPT (0.55) DHODHSERPINE1NR1H4NPC1RAB9A
SCHEMBL8044197 0.77 DHODH (0.79) DHODHKDM4ENR1H4SLC16A3NPC1
SCHEMBL6357745 0.77 DHODH (0.78) DHODHKDM4ENR1H4SLC16A3NPC1

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US claimed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 WO claimed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 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-20030073862-A1 Compounds PPARG, PPARA, PPARD DHODH 2616/4885SERPINE1 1107/4885KDM4E 2125/4885

“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.