SCHEMBL26443202

SCHEMBL26443202

Cc1ccc(N(c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(C)ccc3-4)cc2)c2ccc(-c3ccc4c5ccccc5n(-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)c4c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ PDK2 Q15119 2/20 0.33
▸ PGR P06401 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ RXFP1 Q9HBX9 2/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ TSPO P30536 1/20 0.30

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
SCHEMBL26443177 1.00 ALDH1A1 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443113 0.99 ALDH1A1 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443217 0.99 ALDH1A1 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443210 0.99 ALDH1A1 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443181 0.99 PDK2 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443206 0.99 PDK2 (0.33) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443214 0.95 PDK2 (0.35) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443178 0.94 TSPO (0.36) ALDH1A1LMNAGAAPDK2PGR
SCHEMBL26443147 0.94 PDK2 (0.33) ALDH1A1PDK2PGRRXFP1RXRA
SCHEMBL26443186 0.94 AKR1C4 (0.35) ALDH1A1PDK2PGRKDM4EATM

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-20230126748-A1 POLYMER, A COMPOSITION, AND AN ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-04-27 — — US disclosed
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