SCHEMBL21919154

SCHEMBL21919154

Cc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc4c5ccccc5n(C)c4c3)ccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.38
▸ HPGD P15428 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ GPR3 P46089 1/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ RXRA P19793 1/20 0.36
▸ RXRB P28702 1/20 0.36
▸ BCHE P06276 2/20 0.34
▸ ACHE P22303 2/20 0.34
▸ ALK Q9UM73 1/20 0.34
▸ MAPT P10636 4/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ ATM Q13315 1/20 0.33
▸ TSHR P16473 1/20 0.32

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
SCHEMBL21919222 0.97 RXRA (0.41) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL21919153 0.91 BCHE (0.36) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL11922025 0.88 RXRA (0.42) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL12116329 0.87 GPR3 (0.37) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL12116330 0.87 GPR3 (0.39) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL25563043 0.87 KDM4E (0.37) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL15682255 0.87 KDM4E (0.34) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL12116325 0.86 KDM4E (0.33) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL21919228 0.84 GPR3 (0.48) KDM4EHPGDALDH1A1HSD17B10GPR3
SCHEMBL16545322 0.84 PDK2 (0.40) KDM4EALDH1A1MAPTLMNARAB9A

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-11186676-B2 Polymer containing S,S-dioxide-dibenzothiophene in backbone chain with content-adjustable triarylamine end groups and preparation method and application thereof SOUTH CHINA UNIVERSITY OF TECHNOLOGY (CN) 2021-11-30 — — US disclosed
US-20200109237-A1 POLYMER CONTAINING S,S-DIOXIDE-DIBENZOTHIOPHENE IN BACKBONE CHAIN WITH CONTENT-ADJUSTABLE TRIARYLAMINE END GROUPS AND PREPARATION METHOD AND APPLICATION THEREOF SOUTH CHINA UNIVERSITY OF TECHNOLOGY (CN) 2020-04-09 — — US disclosed
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