SCHEMBL1107311

SCHEMBL1107311

CC(C)C(=O)[C@H](CC1CCCCC1)N1Cc2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ REN P00797 4/20 0.51
▸ MAPK1 P28482 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ USP19 O94966 3/20 0.48
▸ POLB P06746 1/20 0.48
▸ SDCBP O00560 1/20 0.48
▸ SDC2 P34741 1/20 0.48
▸ THRB P10828 2/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 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
SCHEMBL2669076 0.89 ALOX15 (0.52) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL6184728 0.88 ALOX15 (0.63) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL1097924 0.88 ALOX15 (0.63) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL1097927 0.88 ALOX15 (0.63) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL6187371 0.88 ALOX15 (0.63) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL6186957 0.88 ALOX15 (0.63) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL13584056 0.86 ALOX15 (0.64) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL6187235 0.86 ALOX15 (0.64) ALOX15MAPTSMN1; SMN2RENMAPK1
SCHEMBL13585171 0.81 ALOX15 (0.67) ALOX15MAPTSMN1; SMN2MAPK1KDM4E
SCHEMBL13585168 0.81 ALOX15 (0.67) ALOX15MAPTSMN1; SMN2MAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2012-06-07 — — US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 — — US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 — — US disclosed
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 — — US disclosed
US-7910747-B2 Phosphonate and phosphinate pyrazolylamide glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-22 — — US disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 — — US disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 — — 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 (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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, MPO, GCK ALOX15 3476/4885MAPT 4710/4885SMN1; SMN2 4603/4885
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 ALOX15 3777/4885MAPT 4511/4885SMN1; SMN2 4710/4885
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 ALOX15 3967/4885MAPT 4446/4885SMN1; SMN2 4647/4885

“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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