SCHEMBL25632500

SCHEMBL25632500

Cc1cccc(-c2cc(N(c3ccccc3)c3cccc4c3[nH]c3ccccc34)c3ccc4c(-c5cccc(C)c5)cc(N(c5ccccc5)c5cccc6c5oc5ccccc56)c5ccc2c3c45)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.33
KIF11 P52732 2/20 0.33
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
PPARG P37231 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
NR1I3 Q14994 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CAMK2B Q13554 1/20 0.31
CAMK2G Q13555 1/20 0.31
CAMK2D Q13557 1/20 0.31
CAMK2A Q9UQM7 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CA12 O43570 2/20 0.31
CA9 Q16790 2/20 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
SCHEMBL4085670 0.90 ALOX5 (0.36) ALDH1A1CYP1A1CYP1A2CYP1B1CA12
SCHEMBL15045812 0.86 ALOX5 (0.34) ALDH1A1CYP1A1CYP1A2CYP1B1CA12
SCHEMBL25783743 0.84 CYP1A1 (0.33) ALDH1A1CYP1A1CYP1A2CYP1B1CA12
SCHEMBL23849125 0.82 ALOX5 (0.38) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL23849426 0.81 ALOX5 (0.36) CYP1A1CYP1A2CYP1B1ALOX5
SCHEMBL26502776 0.79 L3MBTL1 (0.31) L3MBTL1
SCHEMBL12206530 0.79 ALOX5 (0.34) CYP1A1CYP1A2CYP1B1CA12CA9
SCHEMBL21163906 0.78 ALOX5 (0.33) ALDH1A1CYP1A1CYP1A2CYP1B1ALOX5
SCHEMBL4079386 0.78 ALOX5 (0.36) ALDH1A1LMNAHPGDALOX5
SCHEMBL4088972 0.77 ALOX5 (0.36) ALDH1A1CYP1A1CYP1A2CYP1B1HPGD

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
US-20230189544-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-15 US disclosed