Anisole

Anisole

SCHEMBL27291300

COc1cc2c(c(OC)c1OC)CCC2.COc1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 3/20 0.44
TUBB P07437 3/20 0.44
TUBA3C P0DPH7 3/20 0.44
TUBA1B P68363 3/20 0.44
TUBA4A P68366 3/20 0.44
TUBB4B P68371 3/20 0.44
TUBB3 Q13509 3/20 0.44
TUBB2A Q13885 3/20 0.44
TUBB8 Q3ZCM7 3/20 0.44
TUBA3E Q6PEY2 3/20 0.44
TUBA1A Q71U36 3/20 0.44
TUBA1C Q9BQE3 3/20 0.44
TUBB6 Q9BUF5 3/20 0.44
TUBB2B Q9BVA1 3/20 0.44
TUBB1 Q9H4B7 3/20 0.44
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
CA4 P22748 1/20 0.42
DRD1 P21728 1/20 0.41

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
Anisole SCHEMBL27277827 0.72 CA4 (0.67) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL21596850 0.70 DRD1 (0.44) CA4DRD1MEN1KMT2AACHE
SCHEMBL31605597 0.70 DRD1 (0.44) CA4DRD1MEN1KMT2AACHE
SCHEMBL11626560 0.70 ALDH1A1 (0.49) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7445824 0.69 ATM (0.63) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7676354 0.68 MEN1 (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Anisole SCHEMBL28183278 0.68 CA4 (0.82) CA4MEN1KMT2AMAPTACHE
Anisole SCHEMBL28179768 0.67
Anisole SCHEMBL8144116 0.67 CA4 (0.64) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Anisole SCHEMBL28247668 0.67 CA4 (0.64) LMNAPOLBCA4MEN1KMT2A

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
CN-1012495-B Preparation method and application of benzoquinone derivative TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1991-05-01 CN disclosed
CN-85105976-A The preparation method of quinone derivatives and purposes 1986-10-22 CN disclosed