SCHEMBL97017

SCHEMBL97017

O=CCCCc1c(F)cc(F)cc1F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.36
ERN1 O75460 1/20 0.35
TAAR1 Q96RJ0 2/20 0.33
CNR1 P21554 1/20 0.33
TRPV1 Q8NER1 1/20 0.31
TSHR P16473 1/20 0.31
RIPK1 Q13546 1/20 0.30

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
SCHEMBL4844190 0.87 ERN1 (0.38) ERN1TAAR1CNR1RIPK1
SCHEMBL18243005 0.76 TAAR1 (0.37) ERN1TAAR1CNR1RIPK1
SCHEMBL31752852 0.75 POLB (0.43) ERN1
SCHEMBL18242970 0.74 TAAR1 (0.35) TAAR1CNR1RIPK1
SCHEMBL1428232 0.73 ERN1 (0.40) ERN1CNR1RIPK1
SCHEMBL26112616 0.73 HIF1A (0.43) HIF1ATRPV1TSHR
SCHEMBL28156208 0.72 TAAR1 (0.34) TAAR1CNR1RIPK1
SCHEMBL19659223 0.72 RAPGEF4 (0.31)
SCHEMBL95843 0.72 HIF1A (0.33) HIF1AERN1
SCHEMBL97550 0.72 DAO (0.37) HIF1AERN1TAAR1TRPV1TSHR

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 HIF1A 775/4885ERN1 755/4885TAAR1 3793/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 HIF1A 1411/4885ERN1 3550/4885TAAR1 2154/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 HIF1A 1411/4885ERN1 3550/4885TAAR1 2154/4885

“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.