SCHEMBL3742233

SCHEMBL3742233

Fc1cccc2sc(Oc3ccc4cc[nH]c4c3)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
MAPK1 P28482 2/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 9/20 0.40
RAB9A P51151 8/20 0.40
ALDH1A1 P00352 7/20 0.40
NPC1 O15118 7/20 0.40
HPGD P15428 6/20 0.40
KDM4E B2RXH2 5/20 0.40
LMNA P02545 5/20 0.40
GAA P10253 4/20 0.40
PRNP P04156 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 5/20 0.38
AHR P35869 1/20 0.38
TSHR P16473 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38

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
SCHEMBL3744629 0.80 CYP1A2 (0.51) MEN1KMT2AMAPK1POLBSMN1; SMN2
SCHEMBL3747153 0.77 LTA4H (0.53) MEN1KMT2AMAPK1POLBLTA4H
SCHEMBL3746253 0.69 CYP1A2 (0.51) SMN1; SMN2LTA4HEPHX2
SCHEMBL3751756 0.69 LTA4H (0.44) MEN1KMT2AMAPK1POLBALDH1A1
SCHEMBL745331 0.69 LTA4H (0.48) MEN1KMT2ASMN1; SMN2RAB9AALDH1A1
SCHEMBL745104 0.69 LTA4H (0.48) MEN1KMT2ASMN1; SMN2RAB9AALDH1A1
SCHEMBL7499820 0.68 AHR (0.63) MEN1KMT2AMAPK1POLBALDH1A1
SCHEMBL10445811 0.67 SMN1; SMN2 (0.47) MEN1KMT2AMAPK1SMN1; SMN2RAB9A
SCHEMBL2534126 0.66 KMT2A (0.59) MEN1KMT2AMAPK1POLBALDH1A1
SCHEMBL17423787 0.66 MEN1 (0.59) MEN1KMT2AMAPK1POLBSMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430019-B1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2013-09-18 EP disclosed
EP-2430019-B1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2013-09-18 EP disclosed
US-8399465-B2 Compounds with two fused bicyclic heteroaryl moieties as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-03-19 US disclosed
US-8399465-B2 Compounds with two fused bicyclic heteroaryl moieties as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-03-19 US disclosed
US-8399465-B2 Compounds with two fused bicyclic heteroaryl moieties as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-03-19 US disclosed
WO-2010132599-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 WO disclosed
US-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 US disclosed
US-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 US disclosed
US-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-11-18 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-20100292208-A1 COMPOUNDS WITH TWO FUSED BICYCLIC HETEROARYL MOIETIES AS MODULATORS OF LEUKOTRIENE A4 HYDROLASE LTA4H, LTC4S, LTB4R MEN1 4466/4885KMT2A 2933/4885MAPK1 4700/4885

“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.