SCHEMBL16627992

SCHEMBL16627992

CC(C)(C)c1cc(O)c(-c2ccccn2)c(C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CCR1 P32246 2/20 0.39
▸ CCR5 P51681 2/20 0.39
▸ CCR8 P51685 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ METAP1 P53582 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ DOHH Q9BU89 1/20 0.39
▸ P4HTM Q9NXG6 1/20 0.39
▸ SQOR Q9Y6N5 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ BCR P11274 1/20 0.39

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
SCHEMBL14821700 0.80 HSP90AA1 (0.49) METAP2TRPV1CYP3A4CYP2C9CYP2C19
SCHEMBL30178546 0.80 HSP90AA1 (0.49) METAP2TRPV1CYP3A4CYP2C9CYP2C19
SCHEMBL25428854 0.79 ALDH1A1 (0.52) METAP2TRPV1KDM4ECYP1A2CCR1
SCHEMBL29387025 0.77 ALDH1A1 (0.50) CYP3A4CYP2C9CYP2C19KDM4ECYP1A2
SCHEMBL2172272 0.77 ALDH1A1 (0.50) CYP3A4CYP2C9CYP2C19KDM4ECYP1A2
SCHEMBL18760760 0.76 KDM4E (0.50) METAP2TRPV1KDM4ECYP1A2CCR1
SCHEMBL14864032 0.76 METAP2 (0.44) METAP2TRPV1KDM4ECYP1A2CCR1
SCHEMBL8500242 0.74 KDM4E (0.50) METAP2CYP3A4CYP2C9KDM4ECYP1A2
SCHEMBL12204551 0.74 METAP2 (0.50) METAP2TRPV1KDM4ECYP1A2CCR1
SCHEMBL11124529 0.73 ALDH1A1 (0.46) TRPV1CYP3A4CYP2C9CYP2C19KDM4E

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-9469799-B2 Metal containing condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-10-18 — — US disclosed
US-9469799-B2 Metal containing condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-10-18 — — US disclosed
US-20150337190-A1 Metal Containing Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW SILICONES CORPORATION 2015-11-26 — — US disclosed
US-20150337190-A1 Metal Containing Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW SILICONES CORPORATION 2015-11-26 — — US disclosed
US-9139699-B2 Metal containing condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2015-09-22 — — US disclosed
US-9139699-B2 Metal containing condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2015-09-22 — — US disclosed
WO-2015050583-A1 METAL CONTAINING CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2015-04-09 — — WO disclosed
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