SCHEMBL2125461

SCHEMBL2125461

O=c1c2ccccc2sc2c(OCC(O)CO)ccc(F)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.43
KMT2A Q03164 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 3/20 0.43
CYP2C19 P33261 2/20 0.43
LMNA P02545 4/20 0.39
AGTR1 P30556 1/20 0.39
MAPT P10636 4/20 0.38
CYP3A4 P08684 3/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
POLB P06746 3/20 0.34
CYP2D6 P10635 3/20 0.34
HIF1A Q16665 2/20 0.34

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
SCHEMBL2126862 0.86 CYP1A2 (0.43) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL27905187 0.83 CYP1A2 (0.46) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL2127382 0.80 PTPN1 (0.49) CYP1A2KDM4ECYP2C19MAPTCYP3A4
SCHEMBL28029580 0.80 CYP1A2 (0.55) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL10058703 0.80 MAPT (0.41) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL2763154 0.79 NPC1 (0.40) CYP1A2CYP2C19MAPTCYP3A4RAB9A
SCHEMBL1614172 0.79 MAPT (0.43) CYP1A2KMT2AMEN1CYP2C19LMNA
SCHEMBL13113515 0.78 MAPT (0.42) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL8032089 0.77 MAPT (0.41) CYP1A2KMT2AKDM4EMEN1CYP2C19
SCHEMBL15097126 0.77 LMNA (0.32) CYP1A2KMT2AKDM4EMEN1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159779-A1 Method of Manufacturing Printed Circuit Boards AGFA-GEVAERT NV (BE) 2023-05-25 US disclosed
US-20230159779-A1 Method of Manufacturing Printed Circuit Boards AGFA-GEVAERT NV (BE) 2023-05-25 US disclosed
EP-2868650-B1 Synthesis of acetal compounds using zwitterionic catalysts AGFA NV (BE) 2018-08-08 EP disclosed
US-9982072-B2 Synthesis of acetal compounds AGFA NV (BE) 2018-05-29 US disclosed
US-9982072-B2 Synthesis of acetal compounds AGFA NV (BE) 2018-05-29 US disclosed
EP-2604663-B1 Curable liquids and inkjet inks for food packaging applications AGFA GRAPHICS NV (BE) 2017-08-09 EP disclosed
EP-2604663-B1 Curable liquids and inkjet inks for food packaging applications AGFA GRAPHICS NV (BE) 2017-08-09 EP disclosed
US-9718971-B2 Curable liquids and inkjet inks for food packaging applications AGFA GRAPHICS NV (BE) 2017-08-01 US disclosed
US-9718971-B2 Curable liquids and inkjet inks for food packaging applications AGFA GRAPHICS NV (BE) 2017-08-01 US disclosed
US-9718971-B2 Curable liquids and inkjet inks for food packaging applications AGFA GRAPHICS NV (BE) 2017-08-01 US disclosed
EP-2604663-A1 Curable liquids and inkjet inks for food packaging applications Agfa Graphics N.V. (BE) 2013-06-19 EP disclosed
EP-2604663-A1 Curable liquids and inkjet inks for food packaging applications Agfa Graphics N.V. (BE) 2013-06-19 EP disclosed
CN-103154055-A Led curable compositions AGFA GEVAERT 2013-06-12 CN disclosed
CN-103153979-A Polymerisable photoinitiators for led curable compositions AGFA GEVAERT 2013-06-12 CN disclosed
EP-2447259-A1 Polymerisable photoinitiators for LED curable compositions Agfa-Gevaert (BE) 2012-05-02 EP disclosed
WO-2012052291-A1 LED CURABLE COMPOSITIONS AGFA-GEVAERT (BE) 2012-04-26 WO disclosed
WO-2012052291-A1 LED CURABLE COMPOSITIONS AGFA-GEVAERT (BE) 2012-04-26 WO disclosed
WO-2012052288-A1 POLYMERISABLE PHOTOINITIATORS FOR LED CURABLE COMPOSITIONS AGFA-GEVAERT (BE) 2012-04-26 WO disclosed
EP-2444429-A1 Led curable compositions Agfa-Gevaert (BE) 2012-04-25 EP disclosed
EP-2444429-A1 Led curable compositions Agfa-Gevaert (BE) 2012-04-25 EP disclosed