SCHEMBL12971605

SCHEMBL12971605

COc1c(C)cc(C(C)(CC(C)C)c2cc(C)c(OC(=O)c3ccc(C(C)=O)cc3)c(C)c2)cc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 1/20 0.37
▸ TUBB P07437 1/20 0.37
▸ TUBA3C P0DPH7 1/20 0.37
▸ TUBA1B P68363 1/20 0.37
▸ TUBA4A P68366 1/20 0.37
▸ TUBB4B P68371 1/20 0.37
▸ TUBB3 Q13509 1/20 0.37
▸ TUBB2A Q13885 1/20 0.37
▸ TUBB8 Q3ZCM7 1/20 0.37
▸ TUBA3E Q6PEY2 1/20 0.37
▸ TUBA1A Q71U36 1/20 0.37
▸ TUBA1C Q9BQE3 1/20 0.37
▸ TUBB6 Q9BUF5 1/20 0.37
▸ TUBB2B Q9BVA1 1/20 0.37
▸ TUBB1 Q9H4B7 1/20 0.37
▸ TAS1R3 Q7RTX0 1/20 0.37
▸ TAS1R1 Q7RTX1 1/20 0.37
▸ KMT2A Q03164 7/20 0.36
▸ MAPT P10636 6/20 0.34
▸ GAA P10253 4/20 0.33

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
SCHEMBL12442202 0.97 TUBB4A (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15756133 0.94 ESR1 (0.34) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL12442183 0.94 MAPT (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL12971606 0.92 KMT2A (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL12925840 0.91 MAPT (0.41) KMT2AMAPTGAAALDH1A1PKM
SCHEMBL12442226 0.90 AAK1 (0.34) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL12971604 0.87 NPC1 (0.37) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL12925853 0.87 KMT2A (0.43) KMT2AMAPTL3MBTL1MEN1SMN1; SMN2
SCHEMBL12925833 0.84 KMT2A (0.43) KMT2AMAPTL3MBTL1MEN1SMN1; SMN2
SCHEMBL13084533 0.84 TUBB4A (0.37) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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-8568893-B2 Birefringent film and polarizer NITTO DENKO CORPORATION (JP) 2013-10-29 — — US disclosed
US-20100328772-A1 BIREFRINGENT FILM AND POLARIZER NITTO DENKO CORPORATION (JP) 2010-12-30 — — US disclosed
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