SCHEMBL24043448

SCHEMBL24043448

Nc1cccc(-c2cccc(N(c3ccccc3)c3cc(Cl)cc(N(c4ccccc4)c4ccccc4)c3)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.52
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 4/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MCL1 Q07820 1/20 0.39
MEN1 O00255 3/20 0.38
HPGD P15428 3/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 2/20 0.38
MECP2 P51608 1/20 0.38
MAP4K4 O95819 2/20 0.38
PSIP1 O75475 1/20 0.37
AXL P30530 1/20 0.37

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
SCHEMBL25952725 0.89 CYP1A2 (0.40) MAOAALDH1A1KDM4EMAPTCYP1A2
SCHEMBL28027754 0.88 MAOA (0.65) MAOAALDH1A1KDM4EMAPTCYP1A2
SCHEMBL25740892 0.83 RXRA (0.42) MAOAALDH1A1KDM4EMAPTCYP1A2
SCHEMBL24119724 0.83 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTCYP1A2CYP3A4
SCHEMBL16318369 0.80 TAAR1 (0.43) MAOAALDH1A1KDM4EMAPTCYP1A2
SCHEMBL25128623 0.80 MAOA (0.69) MAOAALDH1A1KDM4EMAPTCYP1A2
SCHEMBL17370152 0.79 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTCYP1A2CYP3A4
SCHEMBL26007719 0.78 TP53 (0.32) ALDH1A1KDM4EMAPTCYP1A2CYP3A4
SCHEMBL17370154 0.78 CYP1A2 (0.48) ALDH1A1KDM4EMAPTCYP1A2CYP3A4
SCHEMBL20872026 0.78 NPC1 (0.46) MAPTNPC1TP53RAB9ASMN1; SMN2

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-20210367156-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-25 US disclosed