SCHEMBL1473504

SCHEMBL1473504

CC(C(=O)O)c1cncc(C(=C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ CYP3A4 P08684 2/20 0.38
▸ CYP3A5 P20815 2/20 0.38
▸ CKS1B P61024 1/20 0.38
▸ SKP1 P63208 1/20 0.38
▸ SKP2 Q13309 1/20 0.38
▸ GPR119 Q8TDV5 2/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ GRM5 P41594 1/20 0.37

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
SCHEMBL1473049 0.82 FNTA (0.46) FNTAFNTBKDM4EPKMMEN1
SCHEMBL24621774 0.82 KDM4E (0.53) FNTAFNTBKDM4EPKMMEN1
SCHEMBL12828694 0.80 CYP2C9 (0.46) FNTAFNTBKDM4EPKMMEN1
SCHEMBL1473141 0.80 FNTA (0.43) FNTAFNTBKDM4EPKMMEN1
SCHEMBL1473090 0.78 TSHR (0.40) KDM4EPKMTSHRMEN1KMT2A
SCHEMBL1472918 0.76 GPR119 (0.48) FNTAFNTBKDM4EPKMCKS1B
SCHEMBL1473046 0.76 GPR119 (0.45) FNTAFNTBKDM4EPKMMEN1
SCHEMBL1473097 0.76 MEN1 (0.49) FNTAFNTBKDM4EPKMMEN1
SCHEMBL12829039 0.74 GPR119 (0.45) FNTAFNTBKDM4EPKMCKS1B
SCHEMBL22491470 0.74 MEN1 (0.44) FNTAFNTBKDM4EPKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915283-B2 e.g. 1-[4-(1-Phenyl-1-(pyrazinyl)-methylene)-piperidin-1-yl]-2-(4-methoxy-7-pyrazinyl-6-azaindol-3-yl)-ethane-1,2-dione; viricides for prophylaxis of lympadenopathy associated virus; synergystic mixtures with immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 — — US disclosed
US-20080188481-A1 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC 4-ALKENYL PIPERIDINE AMIDES BRISTOL-MYERS SQUIBB COMPANY 2008-08-07 — — US 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 (1 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-20080188481-A1 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC 4-ALKENYL PIPERIDINE AMIDES IDO1, IDO2, INMT FNTA 2583/4885FNTB 3319/4885KDM4E 111/4885

“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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