SCHEMBL4145519

SCHEMBL4145519

NNc1cc(F)c2[nH]c(=O)cc(Cl)c2c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
CNR1 P21554 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
AR P10275 1/20 0.31
EIF4A3 P38919 1/20 0.31
NOS2 P35228 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
MAP2 P11137 1/20 0.30

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
SCHEMBL9775929 0.71 EIF4A3 (0.41) MAPTKDM4EAREIF4A3NOS2
SCHEMBL4148535 0.71 AR (0.48) MAPTCNR1KDM4EMEN1NPC1
SCHEMBL29974598 0.66 EIF4A3 (0.42) MAPTKDM4EAREIF4A3NOS2
SCHEMBL23689986 0.62 DDR1 (0.40) MAPTCNR1KDM4EAR
SCHEMBL25433555 0.61 MAPT (0.38) MAPTKDM4EAR
SCHEMBL1771326 0.61 AR (0.62) AR
SCHEMBL15076832 0.60 MAPT (0.50) MAPTKDM4EMEN1NPC1RAB9A
SCHEMBL29410718 0.60 MAPT (0.51) MAPTKDM4EMEN1KMT2AAR
SCHEMBL25423146 0.60 MAPT (0.51) MAPTKDM4EMEN1KMT2AAR
SCHEMBL5339401 0.60 RAPGEF4 (0.41) IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1891067-B1 ANDROGEN RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARM INC (US) 2016-01-13 EP disclosed
US-8580811-B2 Androgen receptor modulator methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2013-11-12 US disclosed
US-20120165362-A1 Androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED 2012-06-28 US disclosed
US-8193357-B2 Androgen receptor modulator compounds LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-06-05 US disclosed
US-20090264455-A9 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-10-22 US disclosed
US-20090030027-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-01-29 US disclosed
EP-1891067-A2 ANDROGEN RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 2008-02-27 EP disclosed
WO-2006138347-A2 ANDROGEN RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2006-12-28 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 (3 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-20090030027-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA MAPT 4308/4885CNR1 154/4885KDM4E 1807/4885
US-20120165362-A1 Androgen receptor modulator compounds and methods AR, NR5A1, ESRRA MAPT 4308/4885CNR1 154/4885KDM4E 1807/4885
US-20090264455-A9 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA MAPT 4308/4885CNR1 154/4885KDM4E 1807/4885

“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.