SCHEMBL21760464

SCHEMBL21760464

O=C(O)c1ccc(N(c2ccccc2)c2cccc(-c3ccccc3)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.55
BCL2 P10415 1/20 0.53
TRIM24 O15164 1/20 0.50
TRIM33 Q9UPN9 1/20 0.50
EGFR P00533 1/20 0.50
RXRA P19793 4/20 0.49
RXRB P28702 4/20 0.49
RXRG P48443 1/20 0.49
EPHX2 P34913 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
DHODH Q02127 1/20 0.46
ACMSD Q8TDX5 1/20 0.45
ALOX5 P09917 4/20 0.44
PTGES O14684 3/20 0.44
DAO P14920 1/20 0.43
TSHR P16473 1/20 0.43
NAPRT Q6XQN6 1/20 0.43

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
SCHEMBL31090439 0.97 BCL2 (0.57) KMOBCL2TRIM24TRIM33EGFR
SCHEMBL21765823 0.89 EGFR (0.56) BCL2EGFREPHX2NR1H4ALOX5
SCHEMBL21760526 0.87 EGFR (0.53) BCL2EGFRRXRARXRBALOX5
SCHEMBL14769783 0.87 EGFR (0.53) BCL2EGFRRXRARXRBALOX5
SCHEMBL13136841 0.85 ALDH1A1 (0.50) KMOACMSDALOX5
SCHEMBL13721096 0.85 ALDH1A1 (0.50) KMOACMSDALOX5
SCHEMBL13136835 0.85 ALDH1A1 (0.50) KMOACMSDALOX5
SCHEMBL13720724 0.85 ALDH1A1 (0.50) KMOACMSDALOX5
SCHEMBL13720844 0.85 ALDH1A1 (0.50) KMOACMSDALOX5
SCHEMBL15022724 0.85 ALDH1A1 (0.50) KMOACMSDALOX5

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
US-11637256-B2 Quantum dots with charge-transporting ligands NANOSYS, INC. (US) 2023-04-25 US disclosed
WO-2020040982-A1 QUANTUM DOTS WITH CHARGE-TRANSPORTING LIGANDS NANOSYS, INC. (US) 2020-02-27 WO disclosed
US-20200067006-A1 QUANTUM DOTS WITH CHARGE-TRANSPORTING LIGANDS NANOSYS, INC. (US) 2020-02-27 US disclosed