SCHEMBL12901865

SCHEMBL12901865

C=C/C=C\C=C(/C)Oc1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ACHE P22303 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTK2B Q14289 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
RELA Q04206 1/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
NPC1 O15118 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL20306055 0.84 TDP1 (0.36) CYP3A4TSHRALDH1A1GAAKDM4E
SCHEMBL24554358 0.84 ELANE (0.34) TSHRALDH1A1GAAMAPTTHRB
SCHEMBL18568267 0.82 LMNA (0.58) LMNAACHECYP3A4TSHRALDH1A1
SCHEMBL22098742 0.79 LMNA (0.46) LMNAACHECYP3A4TSHRALDH1A1
SCHEMBL23842847 0.77 LMNA (0.44) LMNAACHEALDH1A1GAAKDM4E
SCHEMBL14445373 0.74 LMNA (0.58) LMNAACHECYP3A4TSHRALDH1A1
SCHEMBL20143362 0.74 JAK3 (0.43) KMT2ATDP1
SCHEMBL18737244 0.74 LMNA (0.40) LMNAACHECYP3A4TSHRALDH1A1
SCHEMBL10532160 0.73 LMNA (0.52) LMNACYP3A4TSHRALDH1A1PTK2B
SCHEMBL20272370 0.70 LMNA (0.44) LMNAACHECYP3A4TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3831614-B1 PLANOGRAPHIC PRINTING PLATE ORIGINAL PLATE, PLANOGRAPHIC PRINTING PLATE ORIGINAL PLATE LAMINATE BODY, PLATEMAKING METHOD FOR PLANOGRAPHIC PRINTING PLATE, AND PLANOGRAPHIC PRINTING METHOD FUJIFILM CORP (JP) 2023-09-06 EP disclosed
WO-2014151620-A1 5-THIAZOLECARBOXAMIDE DERVATIVES AND THEIR USE AS BTK INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-25 WO disclosed
WO-2011021257-A1 METHOD FOR PRODUCING N-SUBSTITUTED CARBAMIC ACID ESTER, METHOD FOR PRODUCING ISOCYANATE USING N-SUBSTITUTED CARBAMIC ACID ESTER, AND COMPOSITION FOR TRANSFERRING AND STORING N-SUBSTITUTED CARBAMIC ACID ESTER CONTAINING N-SUBSTITUTED CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND 旭化成ケミカルズ株式会社 (JP) 2011-02-24 WO disclosed