SCHEMBL237279

SCHEMBL237279

COC(=O)c1cc(C(=O)c2ccc(OC)cn2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 7/20 0.47
VNN1 O95497 1/20 0.46
MAPK1 P28482 2/20 0.44
HSD17B14 Q9BPX1 2/20 0.43
HSD17B1 P14061 2/20 0.43
HSD17B2 P37059 2/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
P4HTM Q9NXG6 2/20 0.41
BACE1 P56817 1/20 0.39

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
SCHEMBL238141 0.86 HSD17B14 (0.46) LTC4SMAPK1HSD17B14HSD17B1HSD17B2
SCHEMBL236631 0.85 MAPK1 (0.44) LTC4SMAPK1HSD17B14HSD17B1HSD17B2
SCHEMBL238157 0.81 MAOB (0.52) LTC4S
SCHEMBL238194 0.80 LTC4S (0.47) LTC4SMAPK1HSD17B1HSD17B2KMT2A
SCHEMBL236387 0.78 LTC4S (0.66) LTC4S
SCHEMBL2258923 0.76 KDM4E (0.60) KDM4ECA1CA2ALDH1A1KMT2A
SCHEMBL236386 0.76 P4HTM (0.48) LTC4SVNN1CA1CA2P4HTM
SCHEMBL1545257 0.74 MAPK1 (0.65) MAPK1KDM4EL3MBTL1CA1CA2
SCHEMBL31296544 0.74 MAPK1 (0.65) MAPK1KDM4EL3MBTL1CA1CA2
SCHEMBL1401556 0.74 KDM4E (0.58) KDM4EL3MBTL1CA1CA2ALDH1A1

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
EP-2406223-A2 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-01-18 EP disclosed
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
WO-2010103297-A2 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS BIOLIPOX AB (SE) 2010-09-16 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 (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 LTC4S 1/4885VNN1 479/4885MAPK1 2441/4885
US-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R LTC4S 1/4885VNN1 502/4885MAPK1 2408/4885

“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.