SCHEMBL96793

SCHEMBL96793

Cc1ccc(C#N)c2c1NC(=O)CC2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 5/20 0.35
DDB1 Q16531 4/20 0.35
KDM1A O60341 1/20 0.34
TSHR P16473 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
UPP1 Q16831 1/20 0.33
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
DAO P14920 1/20 0.32
PDE9A O76083 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CES1 P23141 1/20 0.30
MCL1 Q07820 1/20 0.30
NPC1 O15118 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
SCHEMBL158585 0.82 CRBN (0.40) CRBNDDB1KDM4EALDH1A1DAO
SCHEMBL96585 0.76 MAOA (0.39) CRBNDDB1KDM4EALDH1A1HPGD
SCHEMBL12956926 0.76 CRBN (0.36) CRBNDDB1KDM4EALDH1A1CA12
SCHEMBL98389 0.73 KDM4E (0.46) CRBNDDB1KDM4EALDH1A1HPGD
SCHEMBL14726023 0.73 ADRB2 (0.36) CRBNDDB1ALDH1A1HPGDCA12
SCHEMBL96063 0.73 KCNJ1 (0.34) CRBNDDB1TSHRALDH1A1CA12
SCHEMBL12559672 0.72 CRBN (0.36) CRBNDDB1KDM4EALDH1A1HPGD
SCHEMBL9923325 0.72 TSHR (0.44) TSHRKDM4EALDH1A1HSD17B10NPC1
SCHEMBL12559620 0.70 CES1 (0.43) CRBNDDB1CES1
SCHEMBL19375075 0.70 KDM4E (0.38) TSHRKDM4EALDH1A1UPP1HPGD

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 8 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-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 (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-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 CRBN 949/4885DDB1 3035/4885KDM1A 3066/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 CRBN 949/4885DDB1 3035/4885KDM1A 3066/4885

“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.