SCHEMBL26047756

SCHEMBL26047756

c1ccc2cc(-c3ccc(-c4nc(-c5ccc6ccc7c8ccccc8ccc7c6c5)nc(-c5cccc6oc7ccccc7c56)n4)cc3)ccc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
PIM1 P11309 1/20 0.34
ALDH1A1 P00352 6/20 0.34
KDM4E B2RXH2 5/20 0.34
HSD17B10 Q99714 4/20 0.34
MEN1 O00255 2/20 0.34
TP53 P04637 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 2/20 0.34
MAPT P10636 4/20 0.34
ESR1 P03372 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
ATM Q13315 2/20 0.33
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL24887839 0.98 TDP1 (0.36) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL26047182 0.96 L3MBTL1 (0.38) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL24991056 0.96 TDP1 (0.40) TDP1L3MBTL1CYP1B1ALDH1A1KDM4E
SCHEMBL23759293 0.96 TDP1 (0.40) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL24990506 0.95 TDP1 (0.37) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL26048287 0.95 TDP1 (0.36) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL24887842 0.95 L3MBTL1 (0.39) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL26048021 0.95 L3MBTL1 (0.39) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL26047899 0.94 L3MBTL1 (0.36) TDP1L3MBTL1CYP1A1CYP1B1PIM1
SCHEMBL27368441 0.94 ALDH1A1 (0.38) TDP1L3MBTL1CYP1A1CYP1B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 WO disclosed