SCHEMBL16424752

SCHEMBL16424752

COc1ccc(CC(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)Cc2ccc(OC)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.56
ALDH1A1 P00352 3/20 0.56
CYP3A4 P08684 2/20 0.56
ALOX15 P16050 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
ALOX12 P18054 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
AGXT P21549 2/20 0.52
LTA4H P09960 1/20 0.52
TAAR1 Q96RJ0 1/20 0.52
TDP1 Q9NUW8 2/20 0.50
MAPK1 P28482 1/20 0.50
SLC6A4 P31645 1/20 0.48

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
SCHEMBL3269847 0.87 ALDH1A1 (0.48) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL73472 0.83 IDO1 (0.54) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL15457858 0.82 SMN1; SMN2 (0.44) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL330750 0.81 IDO1 (0.58) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL26695481 0.81 IDO1 (0.54) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL11596580 0.81 IDO1 (0.52) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL3655846 0.81 IDO1 (0.52) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL3719895 0.81 IDO1 (0.52) IDO1ALDH1A1CYP3A4ALOX15TP53
SCHEMBL2756355 0.80 ACHE (0.54) ALDH1A1CYP3A4ALOX15TP53TSHR
SCHEMBL23893975 0.79 IDO1 (0.56) IDO1ALDH1A1CYP3A4ALOX15TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106396736-A Method for growing three-dimensional covalent organic frame material on surface of alpha-Al2O3 ceramic 中国科学院大连化学物理研究所 2017-02-15 CN claimed
WO-2023196122-A1 MOLECULAR WEAVING ADDITIVES TO ENHANCE THE MECHANICAL PROPERTIES OF MATERIALS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-12 WO disclosed
EP-2992947-B1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME KARLSRUHER INST TECHNOLOGIE (DE) 2023-03-01 EP disclosed
CN-106396736-A Method for growing three-dimensional covalent organic frame material on surface of alpha-Al2O3 ceramic 中国科学院大连化学物理研究所 2017-02-15 CN disclosed
EP-2992947-A1 METHOD FOR THE PREPARATION OF MICROPOROUS ORGANIC MEMBRANES, MICROPOROUS ORGANIC MEMBRANES AND USE OF SAME Karlsruher Institut für Technologie (DE) 2016-03-09 EP disclosed
EP-2832767-A1 Method for the Synthesis of Covalent Organic Frameworks Fundación Imdea Nanociencia (ES) 2015-02-04 EP disclosed