SCHEMBL559181

SCHEMBL559181

COC(=O)c1cc(C(=O)c2ccc(Nc3ccc(Cl)cc3)cc2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
HPGD P15428 1/20 0.45
AKR1C3 P42330 2/20 0.45
AKR1C2 P52895 2/20 0.45
P2RX3 P56373 1/20 0.43
KDR P35968 1/20 0.43
ABL1 P00519 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
POLB P06746 4/20 0.41
LMNA P02545 1/20 0.41
DHODH Q02127 1/20 0.41
MAPK1 P28482 1/20 0.41
PTGS2 P35354 2/20 0.41
MAPK13 O15264 1/20 0.41

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
SCHEMBL559668 0.91 MAPT (0.52) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL238194 0.86 LTC4S (0.47) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL2892434 0.84 CES1 (0.50) MAPTMEN1KMT2AHPGDHDAC8
SCHEMBL1724154 0.84 LTC4S (0.49) MAPTMEN1KMT2AHPGDABL1
SCHEMBL559536 0.80 MAPT (0.50) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL2884838 0.80 ALDH1A1 (0.47) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL1721644 0.80 MDM2 (0.42) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL1723626 0.80 P2RX7 (0.43) MAPTMEN1KMT2ACASP3SENP7
SCHEMBL2884732 0.79 KMT2A (0.55) MAPTMEN1KMT2AHPGDNPC1
SCHEMBL230366 0.79 MAPT (0.51) MAPTMEN1KMT2ACASP3SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429994-A1 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-03-21 EP disclosed
US-20120035217-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-02-09 US disclosed
EP-2406223-A2 BIS AROMATIC COMPOUNDS FOR USE AS LTC4 SYNTHASE INHIBITORS Biolipox AB (SE) 2012-01-18 EP 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
WO-2010103283-A1 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-20120035217-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R MAPT 3787/4885MEN1 3988/4885KMT2A 3636/4885
US-20110319431-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R MAPT 3714/4885MEN1 4027/4885KMT2A 3835/4885

“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.