SCHEMBL94989

SCHEMBL94989

[CH2]c1ccc(NC(=O)c2cccc(Oc3ccccc3)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.68
FFAR1 O14842 1/20 0.63
HDAC8 Q9BY41 1/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
FABP1 P07148 1/20 0.61
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
CASP3 P42574 1/20 0.60
SENP8 Q96LD8 1/20 0.60
SENP7 Q9BQF6 1/20 0.60
SENP6 Q9GZR1 1/20 0.60
AR P10275 1/20 0.60
CRHBP P24387 1/20 0.57
CRHR2 Q13324 1/20 0.57
NR1H4 Q96RI1 1/20 0.57
ASF1A Q9Y294 1/20 0.56
AKR1C3 P42330 1/20 0.55
GCK P35557 1/20 0.55

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
SCHEMBL7152809 0.90 FFAR1 (0.75) PGRFFAR1HDAC8NPC1RAB9A
SCHEMBL13601054 0.88 NPC1 (0.77) PGRFFAR1HDAC8NPC1RAB9A
SCHEMBL94247 0.87 PGR (0.79) PGRNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL94749 0.87 PGR (0.79) PGRNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9240473 0.86 PGR (0.84) PGRFFAR1HDAC8NPC1RAB9A
SCHEMBL95395 0.86 NR1H4 (0.68) PGRNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL94980 0.84 NPC1 (0.76) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL30949335 0.83 PGR (0.87) PGRNPC1RAB9ASMN1; SMN2FABP1
SCHEMBL8737301 0.82 FFAR1 (0.69) PGRFFAR1HDAC8NPC1RAB9A
SCHEMBL5694520 0.81 PGR (1.00) PGRNPC1RAB9ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
CN-101489555-A Nf-kappa OTSUKA PHARMA CO LTD (JP) 2009-07-22 CN disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB PGR 2725/4885FFAR1 2284/4885HDAC8 1201/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 PGR 3206/4885FFAR1 505/4885HDAC8 3441/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 PGR 3206/4885FFAR1 505/4885HDAC8 3441/4885

“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.