SCHEMBL14740499

SCHEMBL14740499

C=CCC1(CC=C)c2ccccc2-c2ccc(C=O)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.41
APEX1 P27695 1/20 0.35
PDK2 Q15119 2/20 0.35
RXFP1 Q9HBX9 1/20 0.32
DRD1 P21728 2/20 0.32
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD5 P21918 1/20 0.31
DRD3 P35462 1/20 0.31
KIF11 P52732 2/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 3/20 0.31
CYP2A6 P11509 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
PTGS2 P35354 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL4607556 0.92 ALDH1A1 (0.34) PGRALDH1A1CYP2A6KDM4EPTGS2
SCHEMBL88451 0.82 PGR (0.49) PGRAPEX1PDK2MAPTALDH1A1
SCHEMBL30511096 0.82 PGR (0.49) PGRAPEX1PDK2MAPTALDH1A1
SCHEMBL12982458 0.81 PDK2 (0.38) PGRAPEX1PDK2RXFP1DRD1
SCHEMBL4632003 0.78 PGR (0.40) PGRAPEX1
SCHEMBL1809551 0.78 PDK2 (0.46) PGRAPEX1PDK2MAPTALDH1A1
SCHEMBL27950603 0.75 MAOA (0.41) APEX1PDK2RXFP1DRD1DRD2
SCHEMBL16346749 0.75 ALDH1A1 (0.41) PDK2RXFP1DRD1DRD2DRD4
SCHEMBL16346844 0.75 ALDH1A1 (0.41) PDK2RXFP1DRD1DRD2DRD4
SCHEMBL5846694 0.75 ALDH1A1 (0.41) PDK2RXFP1DRD1DRD2DRD4

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
EP-2573124-A1 PORPHYRIN COPOLYMER CONTAINING QUINOXALINE UNIT, PREPARATION METHOD AND USES THEREOF Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2013-03-27 EP claimed
EP-2573124-B1 PORPHYRIN COPOLYMER CONTAINING QUINOXALINE UNIT, PREPARATION METHOD AND USES THEREOF OCEANS KING LIGHTING SCIENCE (CN) 2015-08-12 EP disclosed
US-8604147-B2 Porphyrin copolymer containing quinoxaline unit, preparation method and uses thereof OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-12-10 US disclosed
EP-2573124-A1 PORPHYRIN COPOLYMER CONTAINING QUINOXALINE UNIT, PREPARATION METHOD AND USES THEREOF Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2013-03-27 EP disclosed
US-20130059994-A1 PORPHYRIN COPOLYMER CONTAINING QUINOXALINE UNIT, PREPARATION METHOD AND USES THEREOF OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-03-07 US disclosed