SCHEMBL312818

SCHEMBL312818

COc1ccc(CNC(C)c2ccccc2)cc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASR P41180 14/20 1.00
LMNA P02545 1/20 0.47
KMT2A Q03164 2/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
TMEM97 Q5BJF2 1/20 0.44
MEN1 O00255 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL311858 1.00 CASR (1.00) CASRLMNAKMT2AAKR1C3AKR1C2
SCHEMBL3930340 1.00 CASR (1.00) CASRLMNAKMT2AAKR1C3AKR1C2
SCHEMBL5083151 0.91 CASR (0.84) CASRLMNAKMT2AAKR1C3AKR1C2
SCHEMBL3923082 0.90 CASR (1.00) CASRKMT2AAKR1C3AKR1C2TMEM97
SCHEMBL5498394 0.89 CASR (0.81) CASRTMEM97
SCHEMBL3930371 0.89 CASR (1.00) CASRTMEM97
SCHEMBL3879837 0.89 CASR (0.81) CASRTMEM97
SCHEMBL3931202 0.89 CASR (1.00) CASRTMEM97
SCHEMBL3920766 0.89 CASR (1.00) CASRKMT2AAKR1C3AKR1C2TMEM97
SCHEMBL3934399 0.89 CASR (1.00) CASRKMT2AMEN1

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486381-B2 Methods of modulating intestinal fluid balance AMGEN INC. (US) 2013-07-16 US claimed
EP-1937233-B1 MODULATING INTESTINAL FLUID BALANCE USING CALCIMIMETICS AMGEN INC (US) 2013-01-09 EP claimed
EP-1858553-A2 METHODS OF DECREASING CALCIFICATION Amgen Inc., (US) 2007-11-28 EP claimed
US-20070249520-A1 STABLE EMULSION FORMULATIONS AMGEN INC. (US) 2007-10-25 US claimed
US-20070060625-A1 Methods of modulating intestinal fluid balance AMGEN INC. (US) 2007-03-15 US claimed
US-20060276534-A1 Methods of decreasing calcification AMGEN INC. (US) 2006-12-07 US claimed
WO-2006102061-A2 METHODS OF DECREASING CALCIFICATION AMGEN INC. (US) 2006-09-28 WO claimed
US-8779004-B2 Stable emulsion formulations AMGEN, INC. (US) 2014-07-15 US disclosed
US-8609655-B2 Calcimimetic compound for use in the treatment of epithelial injury AMGEN INC. (US) 2013-12-17 US disclosed
US-8486381-B2 Methods of modulating intestinal fluid balance AMGEN INC. (US) 2013-07-16 US disclosed
EP-1937233-B1 MODULATING INTESTINAL FLUID BALANCE USING CALCIMIMETICS AMGEN INC (US) 2013-01-09 EP disclosed
US-20120232158-A1 METHODS OF TREATING HYPERACIDIC DISORDERS YALE UNIVERISTY 2012-09-13 US disclosed
US-8093299-B2 Methods of treating bowel disorders AMGEN INC. (US) 2012-01-10 US disclosed
US-20070248597-A1 Methods of decreasing vascular calcification using IL-1 inhibitors AMGEN INC. 2007-10-25 US disclosed
US-20070249520-A1 STABLE EMULSION FORMULATIONS AMGEN INC. (US) 2007-10-25 US disclosed
WO-2007027548-A9 METHODS OF MODULATING INTESTINAL FLUID BALANCE AMGEN INC (US) 2007-07-12 WO disclosed
US-20070060625-A1 Methods of modulating intestinal fluid balance AMGEN INC. (US) 2007-03-15 US disclosed
WO-2007027548-A2 METHODS OF MODULATING INTESTINAL FLUID BALANCE AMGEN INC. (US) 2007-03-08 WO disclosed
US-20060276534-A1 Methods of decreasing calcification AMGEN INC. (US) 2006-12-07 US disclosed
WO-2006102061-A2 METHODS OF DECREASING CALCIFICATION AMGEN INC. (US) 2006-09-28 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 (4 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-20120232158-A1 METHODS OF TREATING HYPERACIDIC DISORDERS HRH2, GRPR, SLC10A2 CASR 8/4885LMNA 3403/4885KMT2A 4383/4885
US-20070249520-A1 STABLE EMULSION FORMULATIONS CALCR, CALCB, CALCRL CASR 153/4885LMNA 3745/4885KMT2A 4722/4885
US-20060276534-A1 Methods of decreasing calcification CALCB, CALCA, CALCR CASR 9/4885LMNA 908/4885KMT2A 4227/4885
US-20070060625-A1 Methods of modulating intestinal fluid balance SLC10A2, VIP, FABP2 CASR 23/4885LMNA 3385/4885KMT2A 4851/4885

“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.