SCHEMBL25867926

SCHEMBL25867926

C=C(C)C(=O)Oc1ccc2c(c1)sc1c(OC)c(OC(=O)CC)ccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 3/20 0.37
TUBB P07437 3/20 0.37
TUBA3C P0DPH7 3/20 0.37
TUBA1B P68363 3/20 0.37
TUBA4A P68366 3/20 0.37
TUBB4B P68371 3/20 0.37
TUBB3 Q13509 3/20 0.37
TUBB2A Q13885 3/20 0.37
TUBB8 Q3ZCM7 3/20 0.37
TUBA3E Q6PEY2 3/20 0.37
TUBA1A Q71U36 3/20 0.37
TUBA1C Q9BQE3 3/20 0.37
TUBB6 Q9BUF5 3/20 0.37
TUBB2B Q9BVA1 3/20 0.37
TUBB1 Q9H4B7 3/20 0.37
ESR1 P03372 2/20 0.35
GAA P10253 4/20 0.34
KDM4E B2RXH2 4/20 0.34
KMT2A Q03164 4/20 0.34
MAPK1 P28482 3/20 0.34

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
SCHEMBL25853233 0.92 TUBB4A (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25867987 0.88 ESR1 (0.34) ESR1GAAKDM4EKMT2AMAPK1
SCHEMBL25859788 0.88 KMT2A (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25867866 0.87 KMT2A (0.41) ESR1GAAKDM4EKMT2AMAPK1
SCHEMBL25855449 0.84 TUBB4A (0.39) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25867985 0.84 ESR1 (0.33) ESR1GAAKDM4EKMT2AMAPK1
SCHEMBL25853924 0.80 KMT2A (0.31) GAAKDM4EKMT2AMAPK1GLA
SCHEMBL25854570 0.80 TUBB4A (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25853306 0.80 DYRK1A (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25853784 0.79 ELANE (0.36) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023134598-A1 POLYMERISABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed