SCHEMBL95489

SCHEMBL95489

[CH2]c1ccc(C(=O)NCCc2ccccc2F)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.67
NPC1 O15118 5/20 0.60
PAX8 Q06710 1/20 0.60
KLF5 Q13887 1/20 0.60
NAMPT P43490 1/20 0.58
RAB9A P51151 4/20 0.52
HIF1A Q16665 3/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
SIRT1 Q96EB6 1/20 0.49
CNR1 P21554 1/20 0.49
SNCA P37840 1/20 0.48
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL3065901 0.84 TRPV1 (0.74) TRPV1NPC1PAX8KLF5NAMPT
SCHEMBL1568144 0.82 RAB9A (0.64) TRPV1NPC1PAX8KLF5NAMPT
SCHEMBL16712995 0.81 TRPV1 (0.62) TRPV1NPC1PAX8KLF5NAMPT
SCHEMBL28295485 0.79 TRPV1 (0.60) TRPV1NPC1PAX8KLF5NAMPT
SCHEMBL95051 0.78 HDAC2 (0.73) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL8239350 0.76 SNCA (0.60) TRPV1NPC1PAX8KLF5NAMPT
SCHEMBL8486831 0.75 NPC1 (0.66) TRPV1NPC1RAB9AHIF1AMEN1
SCHEMBL9114164 0.74 TAAR1 (0.55) MEN1KMT2ACNR1ALDH1A1SMN1; SMN2
SCHEMBL1010476 0.74 MTNR1A (0.61) TRPV1NPC1PAX8KLF5RAB9A
SCHEMBL97039 0.74 NPC1 (0.61) TRPV1NPC1NAMPTRAB9APOLB

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 11 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
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 TRPV1 3946/4885NPC1 2361/4885PAX8 2592/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 TRPV1 1394/4885NPC1 2922/4885PAX8 2598/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 TRPV1 1394/4885NPC1 2922/4885PAX8 2598/4885

“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.