SCHEMBL6140265

SCHEMBL6140265

CCC1=C(N=C=O)c2c(CC)ccc3cccc(c23)C1N=C=O

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.37
GABRB2 P47870 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
SCHEMBL9235135 0.73 CYP3A4 (0.32)
SCHEMBL4948313 0.66 NSD2 (0.33)
SCHEMBL626687 0.62 MEN1 (0.35)
SCHEMBL29001162 0.62 CYP3A4 (0.39)
SCHEMBL11496675 0.61
SCHEMBL9235435 0.61 KDM4E (0.32)
SCHEMBL6267727 0.61 CYP3A4 (0.32)
SCHEMBL27469503 0.61 MEN1 (0.36)
SCHEMBL10773442 0.60
SCHEMBL6392583 0.58 MAPT (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358244-A4 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF ARCH CHEM INC (US) 2005-02-09 EP claimed
US-6716913-B1 POLYURETHANE MONOMER IS REACTION PRODUCT OF LOW MOLECULAR WEIGHT POLYOL AND AN ACID ANHYDRIDE; PHOSPHORIC ACID CATALYZES POLYOL-ANHYDRIDE ADDITION REACTIONS WITH ANHYDRIDE RING OPENING MECHANISM; LOW VISCOSITY AND NO SIDE REACTIONS ARCH CHEMICALS, INC. 2004-04-06 US claimed
EP-1358244-A2 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF Arch Chemicals, Inc. (US) 2003-11-05 EP claimed
US-20020156316-A1 Polyols containing carboxyl groups and production thereof ARCH CHEMICALS, INC. 2002-10-24 US claimed
WO-2002042348-A2 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF ARCH CHEMICALS, INC. (US) 2002-05-30 WO claimed
EP-1358244-A4 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF ARCH CHEM INC (US) 2005-02-09 EP disclosed
US-6716913-B1 POLYURETHANE MONOMER IS REACTION PRODUCT OF LOW MOLECULAR WEIGHT POLYOL AND AN ACID ANHYDRIDE; PHOSPHORIC ACID CATALYZES POLYOL-ANHYDRIDE ADDITION REACTIONS WITH ANHYDRIDE RING OPENING MECHANISM; LOW VISCOSITY AND NO SIDE REACTIONS ARCH CHEMICALS, INC. 2004-04-06 US disclosed
EP-1358244-A2 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF Arch Chemicals, Inc. (US) 2003-11-05 EP disclosed
US-20020156316-A1 Polyols containing carboxyl groups and production thereof ARCH CHEMICALS, INC. 2002-10-24 US disclosed
WO-2002042348-A2 POLYOLS CONTAINING CARBOXYL GROUPS AND PRODUCTION THEREOF ARCH CHEMICALS, INC. (US) 2002-05-30 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-20020156316-A1 Polyols containing carboxyl groups and production thereof ACP1, SORD, PHYKPL GABRA1 429/4885GABRB2 685/4885

“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.