SCHEMBL95681

SCHEMBL95681

O=C1CCc2c(O)ccc(-c3ccccc3)c2N1Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC7 Q8WUI4 1/20 0.46
▸ FAAH O00519 1/20 0.44
▸ MGLL Q99685 1/20 0.44
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ EGLN1 Q9GZT9 2/20 0.41
▸ AGTR1 P30556 4/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ DCTPP1 Q9H773 1/20 0.39
▸ TBXA2R P21731 1/20 0.39
▸ AGTR2 P50052 1/20 0.39
▸ PDE3A Q14432 1/20 0.39

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
SCHEMBL96096 0.83 FAAH (0.43) HDAC7FAAHMGLLRAB9ASMN1; SMN2
SCHEMBL97064 0.83 HCRTR1 (0.47) HDAC7FAAHMGLLAGTR1DCTPP1
SCHEMBL97124 0.83 FAAH (0.43) HDAC7FAAHMGLLRAB9ASMN1; SMN2
SCHEMBL97203 0.78 CHRM5 (0.42) HDAC7FAAHMGLLPOLBDCTPP1
SCHEMBL5769842 0.78 MGLL (0.65) HDAC7FAAHMGLLRAB9ASMN1; SMN2
SCHEMBL9653600 0.75 PARL (0.38) LMNACA12CA9
Pyridine SCHEMBL5289557 0.73 CHRM5 (0.39) HDAC7FAAHMGLLAGTR1DCTPP1
SCHEMBL17543987 0.72 CMA1 (0.48) MEN1MAPTHTTKMT2ACHRM5
SCHEMBL98558 0.71 POLB (0.45) POLBEGLN1MEN1RGS12USP2
SCHEMBL17542630 0.71 CMA1 (0.47) MEN1MAPTHTTKMT2A

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 HDAC7 3871/4885FAAH 3506/4885MGLL 1523/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 HDAC7 3871/4885FAAH 3506/4885MGLL 1523/4885

“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.

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