SCHEMBL255162

SCHEMBL255162

O=C=Nc1ccc2c3c(cccc13)C=CC2N=C=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33

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
SCHEMBL7173395 0.79 MEN1 (0.31)
SCHEMBL27661593 0.75
SCHEMBL83099 0.75 CYP3A4 (0.33) CYP3A4
SCHEMBL27659640 0.73
SCHEMBL29193898 0.72 CYP3A4 (0.31) CYP3A4
SCHEMBL10533148 0.69 CYP3A4 (0.48) CYP3A4
SCHEMBL28228911 0.67
SCHEMBL27456957 0.66
SCHEMBL22210 0.65 CYP3A4 (0.62) CYP3A4
SCHEMBL29405309 0.65 CYP3A4 (0.50) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200040112-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL ROQUETTE FRERES (FR) 2020-02-06 US claimed
EP-3601293-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL Roquette Freres (FR) 2020-02-05 EP claimed
WO-2018178567-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL ROQUETTE FRERES (FR) 2018-10-04 WO claimed
EP-3277693-A1 (METH)ACRYLATE-FUNCTIONALIZED EXTENDED ISOSORBIDE Henkel IP & Holding GmbH (DE) 2018-02-07 EP claimed
WO-2016160135-A1 (METH)ACRYLATE-FUNCTIONALIZED EXTENDED ISOSORBIDE Henkel IP & Holding GmbH (DE) 2016-10-06 WO claimed
US-20200040112-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL ROQUETTE FRERES (FR) 2020-02-06 US disclosed
EP-3601293-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL Roquette Freres (FR) 2020-02-05 EP disclosed
WO-2018178567-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL ROQUETTE FRERES (FR) 2018-10-04 WO disclosed
EP-2588549-A1 D1479 STABLE LIQUID BAP PHOTOINITIATOR AND ITS USE IN RADIATION CURABLE COMPOSITIONS DSM IP Assets B.V. (NL) 2013-05-08 EP disclosed
WO-2012003106-A1 D1479 STABLE LIQUID BAP PHOTOINITIATOR AND ITS USE IN RADIATION CURABLE COMPOSITIONS DSM IP ASSETS B.V. (NL) 2012-01-05 WO disclosed
WO-2010028996-A2 METHOD OF FORMING A POLYURETHANE FOAM BASF SE (DE) 2010-03-18 WO disclosed
WO-2007001807-A1 DIRECT THERMOGRAPHIC MATERIALS WITH CROSSLINKED CARRIER LAYER CARESTREAM HEALTH, INC. (US) 2007-01-04 WO disclosed
EP-0934360-A1 POLYMER MIXTURES CONTAINING POLYDIORGANOSILOXANE UREA-CONTAINING COMPONENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-08-11 EP disclosed
WO-1998017726-A1 POLYMER MIXTURES CONTAINING POLYDIORGANOSILOXANE UREA-CONTAINING COMPONENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-04-30 WO disclosed
EP-0822951-A1 POLYDIORGANOSILOXANE POLYUREA SEGMENTED COPOLYMERS AND A PROCESS FOR MAKING SAME MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-02-11 EP disclosed
WO-1996034029-A1 POLYDIORGANOSILOXANE POLYUREA SEGMENTED COPOLYMERS AND A PROCESS FOR MAKING SAME MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-31 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 (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-20200040112-A1 ACRYLIC DERIVATIVES OF 1,4:3,6-DIANHYDROHEXITOL ALG1, DERA, ALG8 CYP3A4 1644/4885

“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.