SCHEMBL7036036

SCHEMBL7036036

O=C(Nc1ccc(OCCc2ccccn2)cc1C(=O)O)c1ccc(Cl)cc1Cl.[LiH]

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.81
PPARA Q07869 4/20 0.53
HPGD P15428 1/20 0.53
SERPINE1 P05121 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 1/20 0.46
PYGL P06737 1/20 0.46
PYGM P11217 1/20 0.46
TP53 P04637 1/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL7035737 0.99 PPARG (0.83) PPARGPPARAHPGDSERPINE1NPC1
SCHEMBL7040287 0.91 PPARG (0.70) PPARGPPARAHPGDSERPINE1NPC1
SCHEMBL7041258 0.90 PPARG (0.71) PPARGPPARAHPGDSERPINE1NPC1
Lithium Ion SCHEMBL7036028 0.90 PPARG (1.00) PPARGPPARAHPGDNPC1RAB9A
SCHEMBL7038360 0.90 PPARG (0.80) PPARGPPARAHPGDNPC1RAB9A
SCHEMBL7037688 0.86 PPARG (0.63) PPARGPPARAHPGDSERPINE1NPC1
SCHEMBL7040746 0.85 PPARG (0.64) PPARGPPARAHPGDSERPINE1NPC1
SCHEMBL7040742 0.84 PPARG (0.59) PPARGPPARANPC1KMT2ATP53
SCHEMBL7033982 0.83 PPARG (0.61) PPARGPPARASERPINE1NPC1RAB9A
SCHEMBL7038277 0.83 PPARG (0.59) PPARGPPARANPC1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US disclosed
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 PPARG 1/4885PPARA 2/4885HPGD 787/4885

“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.