SCHEMBL3523913

SCHEMBL3523913

Cc1cc(OCc2ccccc2C)ccc1/C=C/C(C)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 2/20 0.46
▸ CCND1 P24385 2/20 0.46
▸ CCNB2 O95067 1/20 0.46
▸ CDK1 P06493 1/20 0.46
▸ CCNB1 P14635 1/20 0.46
▸ CCNB3 Q8WWL7 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ SLC26A4 O43511 1/20 0.46
▸ ACHE P22303 1/20 0.43
▸ FFAR1 O14842 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ABL1 P00519 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ ALOX5AP P20292 1/20 0.38
▸ S1PR1 P21453 2/20 0.37
▸ S1PR5 Q9H228 1/20 0.37
▸ SPHK2 Q9NRA0 1/20 0.37
▸ SPHK1 Q9NYA1 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
SCHEMBL3523916 1.00 CDK4 (0.46) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL3523915 1.00 CDK4 (0.46) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL3518865 0.80 MAOB (0.56) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL3518861 0.80 MAOB (0.56) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL3519432 0.78 CDK4 (0.56) CDK4CCND1CCNB2CDK1CCNB1
SCHEMBL3877460 0.76 CYP1A2 (0.44) KDM4EKMT2AALOX5MAPK1TDP1
SCHEMBL3657053 0.76 CYP1A2 (0.44) KDM4EKMT2AALOX5MAPK1TDP1
SCHEMBL3657052 0.76 CYP1A2 (0.44) KDM4EKMT2AALOX5MAPK1TDP1
SCHEMBL3877454 0.76 CYP1A2 (0.44) KDM4EKMT2AALOX5MAPK1TDP1
SCHEMBL3657050 0.76 CYP1A2 (0.44) KDM4EKMT2AALOX5MAPK1TDP1

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
EP-1737809-B1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC (US) 2013-09-18 — — EP disclosed
US-7816367-B2 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC. (US) 2010-10-19 — — US disclosed
US-7649110-B2 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC. (US) 2010-01-19 — — US disclosed
EP-1737809-A4 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC (US) 2007-10-17 — — EP disclosed
US-20070142384-A1 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC. (US) 2007-06-21 — — US disclosed
EP-1737809-A2 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE IN TREATING METABOLIC DISORDERS Amgen, Inc (US) 2007-01-03 — — EP disclosed
US-20060004012-A1 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders AMGEN INC. 2006-01-05 — — US disclosed
WO-2005086661-A2 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC. (US) 2005-09-22 — — 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-20060004012-A1 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders PNLIP, IAPP, GPR119 CDK4 2492/4885CCND1 1324/4885CCNB2 605/4885
US-20070142384-A1 Compounds, pharmaceutical compositions and methods for use in treating metabolic disorders PNLIP, IAPP, GPR119 CDK4 2492/4885CCND1 1324/4885CCNB2 605/4885

“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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