SCHEMBL232741

SCHEMBL232741

CN(c1ccc(Cl)cc1)c1ccc(C(=O)c2cc(Nc3ccc(C(F)(F)F)cc3)cc(C(=O)O)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 5/20 0.52
EPHX2 P34913 2/20 0.47
SRD5A2 P31213 3/20 0.46
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 2/20 0.42
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
NR1H4 Q96RI1 2/20 0.41
PPARA Q07869 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
P2RY14 Q15391 1/20 0.40
GRIK1 P39086 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 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
SCHEMBL2743184 0.91 SRD5A2 (0.47) LTC4SSRD5A2AKR1C3AKR1C2NPC1
SCHEMBL2743180 0.88 LTC4S (0.47) LTC4SEPHX2SRD5A2AKR1C3AKR1C2
SCHEMBL2743179 0.87 LTC4S (0.47) LTC4SEPHX2SRD5A2AKR1C3AKR1C2
SCHEMBL2743185 0.87 MAPK13 (0.47) LTC4SSRD5A2NPC1RAB9A
SCHEMBL231402 0.81 SRD5A2 (0.59) SRD5A2AKR1C3AKR1C2
SCHEMBL2743191 0.80 MEN1 (0.44) LTC4SRAB9A
SCHEMBL232721 0.79 P2RX3 (0.42) LTC4SSRD5A2
SCHEMBL2743190 0.79 LTC4S (0.46) LTC4SSRD5A2AKR1C3AKR1C2
SCHEMBL2743182 0.79 MAPT (0.43) LTC4SSRD5A2AKR1C3AKR1C2NPC1
SCHEMBL232237 0.79 SRD5A2 (0.56) LTC4SSRD5A2NPC1RAB9A

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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 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 (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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R LTC4S 1/4885EPHX2 296/4885SRD5A2 564/4885

“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.