SCHEMBL231986

SCHEMBL231986

COC(=O)c1cc(C(=O)Nc2ccccc2)cc(C(=O)c2ccc(N(C)c3ccc(Cl)cc3)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.46
MAPT P10636 1/20 0.46
PTPN1 P18031 1/20 0.46
PLAU P00749 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
KCNK3 O14649 1/20 0.45
LMNA P02545 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PTPN11 Q06124 1/20 0.43
HTT P42858 1/20 0.43
NOD2 Q9HC29 1/20 0.43
CNR1 P21554 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL231992 0.90 FFAR1 (0.50) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL232108 0.88 MAPT (0.44) RAB9ANPC1MAPTNPSR1MEN1
SCHEMBL232232 0.87 LMNA (0.50) RAB9ANPC1MAPTNPSR1MEN1
SCHEMBL231144 0.87 LTC4S (0.56)
SCHEMBL232400 0.84 HPGD (0.46) RAB9ANPC1MAPTNPSR1MEN1
SCHEMBL231253 0.83 LMNA (0.46) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL232388 0.82 MAPT (0.49) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL230032 0.81 MAPT (0.44) RAB9ANPC1MAPTNPSR1MEN1
SCHEMBL229900 0.81 TUBB4A (0.45) RAB9ANPC1MAPTNPSR1MEN1
SCHEMBL232051 0.79 USP2 (0.53) RAB9ANPC1MAPTMEN1KMT2A

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 RAB9A 3916/4885NPC1 2560/4885MAPT 4117/4885

“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.