SCHEMBL4164586

SCHEMBL4164586

Cc1c(F)cccc1C(=O)N(C)Cc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.66
HPGD P15428 1/20 0.60
MEN1 O00255 2/20 0.58
ALDH1A1 P00352 1/20 0.58
TDP1 Q9NUW8 2/20 0.54
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
MAPT P10636 1/20 0.52
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
HSP90AA1 P07900 1/20 0.50
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49

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
SCHEMBL10330504 0.80 KMT2A (1.00) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL7856179 0.78 KMT2A (0.73) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL15775276 0.77 ESR1 (0.61) KMT2AMEN1ALDH1A1TDP1ESR1
SCHEMBL28146177 0.77 KMT2A (0.54) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL3455022 0.75 HPGD (1.00) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL17339456 0.74 KMT2A (0.51) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL3433281 0.74 HPGD (0.50) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL20269157 0.74 KMT2A (0.68) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL10517999 0.74 HPGD (0.69) KMT2AHPGDMEN1ALDH1A1TDP1
SCHEMBL31672210 0.74 KMT2A (0.67) KMT2AHPGDMEN1ALDH1A1TDP1

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 KMT2A 4088/4885HPGD 272/4885MEN1 3261/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R KMT2A 4088/4885HPGD 272/4885MEN1 3261/4885

“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.