SCHEMBL239257

SCHEMBL239257

O=C(c1ccc(Sc2ccc(F)c(F)c2)c(C(=O)O)c1)c1ccc(NCc2ccc(Cl)cc2)cn1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.47
VNN1 O95497 8/20 0.45
LTC4S Q16873 5/20 0.43
PPARA Q07869 1/20 0.39
IGFBP3 P17936 1/20 0.39
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
GCGR P47871 1/20 0.38
PPARG P37231 1/20 0.37

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
SCHEMBL9988347 0.81 LTC4S (0.41) P4HTMLTC4SIGFBP3KCNQ3KCNQ2
SCHEMBL237853 0.80 P4HTM (0.46) P4HTMVNN1LTC4SPPARAGCGR
SCHEMBL239256 0.80 LTC4S (0.65) LTC4S
SCHEMBL9988833 0.79 LTC4S (0.49) P4HTMVNN1LTC4SPPARAPPARG
SCHEMBL236386 0.78 P4HTM (0.48) P4HTMVNN1LTC4SPPARA
SCHEMBL2755493 0.77 LTC4S (0.67) LTC4S
SCHEMBL237419 0.76 RXRA (0.48) P4HTMLTC4S
SCHEMBL237439 0.74 LTC4S (0.39) P4HTMLTC4S
SCHEMBL236679 0.74 LTC4S (0.51) P4HTMVNN1LTC4SGCGR
SCHEMBL9988164 0.74 LTC4S (0.45) P4HTMLTC4SIGFBP3KCNQ3KCNQ2

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-20120004244-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2011-12-29 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 (2 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-20120004244-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R P4HTM 403/4885VNN1 479/4885LTC4S 1/4885
US-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R P4HTM 745/4885VNN1 502/4885LTC4S 1/4885

“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.