SCHEMBL1469100

SCHEMBL1469100

CCC=Cc1cccc2cc3ccccc3cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
CYP1A2 P05177 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
CCR6 P51684 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
SMPD2 O60906 2/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CHAT P28329 3/20 0.36
TLR8 Q9NR97 1/20 0.36
CHRNB4 P30926 1/20 0.35

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
SCHEMBL30786727 1.00 ALDH1A1 (0.41) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL1469098 1.00 ALDH1A1 (0.41) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL1469921 0.86 TLR8 (0.50) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL1469922 0.86 TLR8 (0.50) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL1469818 0.83 PDE5A (0.42) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL1469816 0.83 PDE5A (0.42) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL615456 0.83 SMPD2 (0.51) SMPD2PTGS1PTGS2CHATMTNR1A
SCHEMBL615455 0.83 SMPD2 (0.51) SMPD2PTGS1PTGS2CHATMTNR1A
SCHEMBL304871 0.83 ALDH1A1 (0.44) ALDH1A1MEN1MITFCYP1A2MAPT
SCHEMBL22288258 0.82 ALDH1A1 (0.49) ALDH1A1MEN1MITFCYP1A2MAPT

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-3875528-B1 USE OF A RUBBER COMPOSITION IN A PNEUMATIC TIRE ZEON CORP (JP) 2026-01-14 EP disclosed
EP-3875528-A1 RUBBER COMPOSITION AND PNEUMATIC TIRE USING SAME Zeon Corporation (JP) 2021-09-08 EP disclosed
EP-2202832-B1 SOLID POLYMER ELECTROLYTE MEMBRANE, METHOD FOR PRODUCING THE SAME, MEMBRANE-ELECTRODE ASSEMBLY FOR FUEL CELL, AND FUEL CELL SHINETSU CHEMICAL CO (JP) 2011-11-02 EP disclosed
US-20110070523-A1 SOLID POLYMER ELECTROLYTE MEMBRANE, METHOD FOR PRODUCING THE SAME, MEMBRANE-ELECTRODE ASSEMBLY FOR FUEL CELL, AND FUEL CELL SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-03-24 US disclosed
EP-2202832-A1 SOLID POLYMER ELECTROLYTE MEMBRANE, METHOD FOR PRODUCING THE SAME, MEMBRANE-ELECTRODE ASSEMBLY FOR FUEL CELL, AND FUEL CELL Shin-Etsu Chemical Co., Ltd. (JP) 2010-06-30 EP disclosed