SCHEMBL29015779

SCHEMBL29015779

CCCCCCCCOC(=O)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.49
AKR1C4 P17516 1/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C2 P52895 1/20 0.49
AKR1C1 Q04828 1/20 0.49
CNR2 P34972 1/20 0.47
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
F2R P25116 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL31390244 1.00 ESR1 (0.49) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL4835939 0.96 ESR1 (0.41) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL28616481 0.89 ESR1 (0.45) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL7563193 0.87 F2R (0.40) LMNAALDH1A1F2RNPC1MAPT
SCHEMBL19216393 0.84 ALDH1A1 (0.43) CNR2LMNATSHRALDH1A1TP53
SCHEMBL28348260 0.84 ESR1 (0.42) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL30313741 0.84 ESR1 (0.42) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL3858691 0.83 ALDH1A1 (0.36) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL30963008 0.83 ALDH1A1 (0.36) LMNATSHRALDH1A1TP53CYP3A4
SCHEMBL30963009 0.83 ALDH1A1 (0.36) LMNATSHRALDH1A1TP53CYP3A4

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
CN-118426259-A Colored photosensitive resin composition, colored pattern, color filter and image display device 东友精细化工有限公司 2024-08-02 CN disclosed
CN-113423513-B Light-resistant hard coating curable composition 日产化学株式会社 2023-08-15 CN disclosed
CN-109891320-B Metal oxide photosensitive resin composition, color filter and image display device manufactured using the same 东友精细化工有限公司 2023-06-20 CN disclosed