SCHEMBL7980263

SCHEMBL7980263

COc1cc2c(cc1OC)-c1cc(OC)c(OC)cc1C2=Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP1B1 Q16678 1/20 0.50
MAPT P10636 7/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 3/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
TUBB1 Q9H4B7 2/20 0.46
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46

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
SCHEMBL7981201 0.83 LMNA (0.57) CYP1A1CYP1A2CYP1B1MAPTTUBB1
SCHEMBL9372014 0.78 NFE2L2 (0.44) MAPTKMT2AMEN1HTTLMNA
SCHEMBL21415991 0.74 CA1 (0.55) CYP1A1CYP1A2CYP1B1MAPTKMT2A
SCHEMBL17164790 0.74 CA1 (0.55) CYP1A1CYP1A2CYP1B1MAPTKMT2A
SCHEMBL7980865 0.74 LCK (0.46) MAPTKMT2AMEN1TUBB1TUBB4A
SCHEMBL8724172 0.73 KDM4E (0.60) CYP1A2MAPTALDH1A1TDP1HPGD
SCHEMBL8724175 0.73 KDM4E (0.60) CYP1A2MAPTALDH1A1TDP1HPGD
SCHEMBL9372017 0.72 TNF (0.46) MAPTKMT2AMEN1TDP1LMNA
SCHEMBL4541307 0.71 CYP19A1 (0.62) MAPTKMT2AMEN1ALDH1A1TUBB1
SCHEMBL4532731 0.71 CYP3A4 (0.53) MAPTALDH1A1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed