SCHEMBL28910972

SCHEMBL28910972

CC(C)(C)c1cc(-c2cccc3c4ccccc4n(C(N)=O)c23)cc(C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.39
▸ RXRA P19793 3/20 0.38
▸ RXRB P28702 2/20 0.38
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36
▸ TUBB2A Q13885 1/20 0.36
▸ TUBB8 Q3ZCM7 1/20 0.36
▸ TUBA3E Q6PEY2 1/20 0.36
▸ TUBA1A Q71U36 1/20 0.36
▸ TUBA1C Q9BQE3 1/20 0.36
▸ TUBB6 Q9BUF5 1/20 0.36
▸ TUBB2B Q9BVA1 1/20 0.36
▸ TUBB1 Q9H4B7 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ DUSP3 P51452 1/20 0.36

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
SCHEMBL24703479 0.78 DUSP3 (0.36) RXRARXRBPPARGDUSP3MAPT
SCHEMBL24775804 0.77 DUSP3 (0.38) RXRARXRBTUBB4ATUBBTUBA3C
SCHEMBL23203894 0.76 DUSP3 (0.36) RXRARXRBTUBB4ATUBBTUBA3C
SCHEMBL25470256 0.76 DUSP3 (0.36) RXRARXRBTUBB4ATUBBTUBA3C
SCHEMBL25470254 0.76 DUSP3 (0.36) RXRARXRBTUBB4ATUBBTUBA3C
SCHEMBL24311511 0.76 ALKBH5 (0.40) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25027474 0.75 PTAFR (0.35) RXRARXRBPPARGDUSP3MAPT
SCHEMBL23490981 0.73 DUSP3 (0.34) PPARGDUSP3
SCHEMBL22199407 0.73 PDCD1 (0.35) RXRARXRBPPARGDUSP3HSD17B10
SCHEMBL21972034 0.73 DUSP3 (0.34) PPARGDUSP3

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
CN-115485312-A Sterically hindered phosphino-urea supported nickel (II) or palladium (II) catalysts for copolymerization of ethylene and polar comonomers 陶氏环球技术有限责任公司 2022-12-16 — — CN disclosed
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