SCHEMBL25847185

SCHEMBL25847185

CC1(C)c2ccccc2-c2ccc(-c3nc4ccccc4c4nnc(-c5cccc(-c6cccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)c7)c6)c5)n34)cc21

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
PDK2 Q15119 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL25685722 0.93 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1LMNAKDM4E
SCHEMBL25516142 0.91 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1LMNAKDM4E
SCHEMBL25516143 0.90 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1LMNAKDM4E
SCHEMBL25762644 0.84 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1LMNA
SCHEMBL12957712 0.80 HPGD (0.59) ALDH1A1LMNAKDM4EHPGDPOLB
SCHEMBL25516138 0.78 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1LMNAKDM4E
SCHEMBL25516139 0.78 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1LMNAKDM4E
SCHEMBL24840152 0.77 ADORA3 (0.55) POLB
SCHEMBL12957613 0.76 HPGD (0.63) ALDH1A1LMNAKDM4EHPGDPOLB
SCHEMBL30297640 0.76 PDK2 (0.53) LMNAPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230225209-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS KUNSHAN GO-VISIONOX OPTO-ELECTRONICS CO., LTD (CN) 2023-07-13 US disclosed
US-20230225209-A1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY APPARATUS KUNSHAN GO-VISIONOX OPTO-ELECTRONICS CO., LTD (CN) 2023-07-13 US disclosed