SCHEMBL180679

SCHEMBL180679

CC(C)(C)Oc1c(C=O)cccc1C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.43
CA1 P00915 1/20 0.43
ALOX12 P18054 1/20 0.38
SRC P12931 1/20 0.37
TDP1 Q9NUW8 3/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
ERN1 O75460 3/20 0.36
TLR2 O60603 1/20 0.36
TLR1 Q15399 1/20 0.36
TLR6 Q9Y2C9 1/20 0.36
ALDH1A1 P00352 5/20 0.35
TSHR P16473 2/20 0.35
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32

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
Methyl Alcohol SCHEMBL28273000 0.97 CA2 (0.45) CA2CA1ALOX12SRCTDP1
Ethylenediamine SCHEMBL28437584 0.91 CA2 (0.37) CA2CA1ALOX12SRCTDP1
SCHEMBL2489642 0.84 CA2 (0.58) CA2CA1ALOX12SRCTDP1
SCHEMBL28214308 0.82 ALOX12 (0.38) CA2ALOX12TDP1ALDH1A1TSHR
SCHEMBL12488403 0.80 CA2 (0.48) CA2ALOX12TDP1ALDH1A1TSHR
SCHEMBL1010833 0.79 CA2 (0.41) CA2CA1ALOX12SRCTDP1
SCHEMBL19337367 0.79 CA1 (0.66) CA2CA1SRCTDP1LMNA
SCHEMBL1254406 0.78 ALDH1A1 (0.41) CA2CA1ALOX12SRCERN1
SCHEMBL1728866 0.78 PIM1 (0.44) CA2CA1ALOX12SRCTDP1
SCHEMBL7688417 0.78 LMNA (0.50) CA2CA1ALOX12SRCTDP1

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 542 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12187948-B2 Intelligent anti-icing material and preparation method and use thereof Pan, Lei (CN) 2025-01-07 US claimed
US-20220213367-A1 INTELLIGENT ANTI-ICING MATERIAL AND PREPARATION METHOD AND USE THEREOF UNIV NANJING AERONAUTICS & ASTRONAUTICS (CN) 2022-07-07 US claimed
CN-114146731-A Oligomeric binuclear MOFs epoxy chloropropane kinetic resolution catalyst and synthetic method thereof 湖北楚维药业有限公司 2022-03-08 CN claimed
CN-107301920-A A kind of high oxidative porphyrin is sensitized SnO2Bionical light anode preparation method 哈尔滨工业大学 2017-10-27 CN claimed
CN-103333331-B Macromolecular supported catalyst, and preparation method and application thereof 昆明理工大学 2017-04-12 CN claimed
CN-106220769-A A kind of EP rubbers carbon monoxide-olefin polymeric 山东成泰化工有限公司 2016-12-14 CN claimed
CN-106146341-A A kind of salicylide dehydroabietylamine schiff base compound and its preparation method and application 南京林业大学 2016-11-23 CN claimed
CN-105713121-A Preparation method and application of ethylene-propylene polymerization metal catalyst 中国石油天然气股份有限公司 2016-06-29 CN claimed
CN-105061255-A Series of asymmetric double-Schiff base mononuclear copper complexes, and preparation method and application thereof UNIV XI AN SHIYOU 2015-11-18 CN claimed
CN-105017334-A Chiral metal cobalt (III) complex synthesis method and use of chiral metal cobalt (III) complex UNIV ANHUI AGRICULTURAL 2015-11-04 CN claimed
CN-102580777-A Loaded type salen manganese complex catalyst, preparation method and application thereof UNIV ZHEJIANG 2012-07-18 CN claimed
CN-102380418-A Catalyst for catalyzing and reducing asymmetric prochiral ketones to chiral alcohols, preparation method and application thereof UNIV HANGZHOU NORMAL 2012-03-21 CN claimed
CN-101905171-B Method for preparing Wang resin supported chiral Salon-Co (III) catalyst UNIV SHENYANG CHEMICAL TECH 2011-12-28 CN claimed
CN-101940947-B Method for preparing polystyrene resin-immobilized Salon-Co (III) catalyst UNIV SHENYANG CHEMICAL TECH 2011-12-21 CN claimed
CN-102250137-A 3,5-ditertbutyl salicylidene ethylenediamine iron complex, and preparation method and application thereof UNIV CHONGQING 2011-11-23 CN claimed
CN-101940947-A Method for preparing polystyrene resin-immobilized Salon-Co (III) catalyst UNIV SHENYANG CHEMICAL TECH 2011-01-12 CN claimed
CN-101905171-A Method for preparing Wang resin supported chiral Salon-Co (III) catalyst UNIV SHENYANG CHEMICAL TECH 2010-12-08 CN claimed
CN-101659628-A Titanium complex, preparation method and use thereof UNIV CHONGQING 2010-03-03 CN claimed
CN-100586966-C Bis-salicylaldehyde imine vanadium olefin polymerization catalyst as well as preparation method and application thereof CHANGCHUN APPLIED CHEMISTRY 2010-02-03 CN claimed
CN-101041141-A Aromatic heterocycles Schiff base rare- earth catalyst and the method for preparing the same UNIV ZHEJIANG (CN) 2007-09-26 CN claimed