SCHEMBL799997

SCHEMBL799997

C=C(OC(C)(C)C)C(C)(C)CC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL18700648 0.82 ALDH1A1 (0.38)
SCHEMBL10177506 0.79
SCHEMBL3149443 0.78 TSHR (0.32)
SCHEMBL800440 0.76
SCHEMBL800014 0.75 MEN1 (0.30)
SCHEMBL800000 0.74 ALDH1A1 (0.33)
SCHEMBL800017 0.72
SCHEMBL4823585 0.71
SCHEMBL13586847 0.71 ALDH1A1 (0.33)
SCHEMBL13431273 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546062-B2 Self-forming top anti-reflective coating compositions and, photoresist mixtures and method of imaging using same INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-10-01 US disclosed
US-20120322007-A1 PATTERN FORMING METHOD, CHEMICAL AMPLIFICATION RESIST COMPOSITION AND RESIST FILM FUJIFILM CORPORATION (JP) 2012-12-20 US disclosed
US-8309505-B2 Hand dish composition in the form of an article THE PROCTER & GAMBLE COMPANY (US) 2012-11-13 US disclosed
US-20120070782-A1 SELF-FORMING TOP ANTI-REFLECTIVE COATING COMPOSITIONS AND, PHOTORESIST MIXTURES AND METHOD OF IMAGING USING SAME INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-03-22 US disclosed
US-20110028373-A1 HAND DISH COMPOSITION IN THE FORM OF AN ARTICLE THE PROCTER & GAMBLE COMPANY 2011-02-03 US disclosed