SCHEMBL4157341

SCHEMBL4157341

O=C(c1[c]ccc(F)c1)N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HPGD P15428 1/20 0.45
EPHX2 P34913 1/20 0.45
CNR1 P21554 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 1/20 0.43
AKR1C3 P42330 1/20 0.43
PHGDH O43175 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL4163752 0.86 SMN1; SMN2 (0.47) MAPTTSHRNPC1RAB9AHPGD
SCHEMBL4154957 0.84 SMN1; SMN2 (0.46) TSHRNPC1RAB9AHPGDCNR1
SCHEMBL10399284 0.82 HPGD (0.48) MAPTNPC1RAB9AHPGDMEN1
SCHEMBL4156660 0.82 MEN1 (0.50) TSHRHPGDEPHX2MEN1KMT2A
SCHEMBL971067 0.76 HPGD (0.51) TSHRHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL425630 0.76 PKM (0.54) TSHRHPGDEPHX2KMT2APKM
SCHEMBL16345835 0.73 MAPT (0.50) MAPTTSHRHPGDEPHX2CNR1
SCHEMBL14602602 0.72 CNR1 (0.62) MAPTTSHRNPC1RAB9AEPHX2
SCHEMBL28551127 0.71 PKM (0.48) TSHRHPGDKMT2ASMN1; SMN2PKM
SCHEMBL29119970 0.71 ERN1 (0.54) RAB9AHPGDEPHX2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US disclosed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US disclosed
CN-1950375-A Glucocorticoid receptor modulator compounds and methods- utility LIGAND PHARM INC (US) 2007-04-18 CN disclosed
EP-1718653-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY Ligand Pharmaceuticals Inc. (US) 2006-11-08 EP disclosed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 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-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R MAPT 4695/4885TSHR 244/4885NPC1 1327/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R MAPT 4695/4885TSHR 244/4885NPC1 1327/4885

“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.