SCHEMBL234584

SCHEMBL234584

COC(=O)c1cc(I)cc(C(=O)c2ccc(NCC3(c4ccc(Cl)cc4)CC3)cn2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
RECQL P46063 2/20 0.38
CNR1 P21554 1/20 0.36
LTC4S Q16873 1/20 0.36
P2RX7 Q99572 4/20 0.35
MAPT P10636 3/20 0.35
MAPK1 P28482 2/20 0.35
POLB P06746 1/20 0.35
BACE1 P56817 3/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
P4HTM Q9NXG6 1/20 0.33
GAA P10253 1/20 0.33
PIK3CA P42336 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL240031 0.83 LTC4S (0.42) LTC4SP2RX7
SCHEMBL229858 0.83 MAPT (0.47) KMT2AMEN1CNR1MAPTALDH1A1
SCHEMBL234582 0.75 PLA2G1B (0.37) ATMKMT2AMEN1RECQLLTC4S
SCHEMBL234583 0.72 LTC4S (0.60) LTC4S
SCHEMBL27832535 0.71 LTC4S (0.41) LTC4S
SCHEMBL237439 0.70 LTC4S (0.39) LTC4SP2RX7POLBP4HTM
SCHEMBL1723626 0.69 P2RX7 (0.43) KMT2AMEN1CNR1P2RX7MAPT
SCHEMBL239167 0.68 LTC4S (0.39) LTC4S
SCHEMBL230231 0.67 CNR1 (0.42) CNR1P2RX7BACE1
SCHEMBL232291 0.67 MAPT (0.40) KMT2AMEN1CNR1LTC4SMAPT

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
EP-2406220-A1 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-01-18 EP disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
WO-2010103279-A1 BIS AROMATIC COMPOUNDS FOR USE AS LCT4 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 (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 ATM 3966/4885KMT2A 4283/4885MEN1 4355/4885

“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.