SCHEMBL7984438

SCHEMBL7984438

COc1cc2c(cc1OC)-c1ccccc1C2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
CYP3A4 P08684 2/20 0.56
DRD1 P21728 2/20 0.51
DRD4 P21917 2/20 0.51
DRD5 P21918 2/20 0.51
KDM4E B2RXH2 3/20 0.50
RAB9A P51151 2/20 0.50
MAPK1 P28482 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
ACHE P22303 1/20 0.49
ALDH1A1 P00352 3/20 0.48
LMNA P02545 2/20 0.48
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PDE10A Q9Y233 1/20 0.48
MEN1 O00255 3/20 0.48

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
SCHEMBL7981630 0.85 MAPT (0.75) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL28999524 0.83 KDM4E (0.47) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL25646743 0.83 CYP3A4 (0.54) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL8081751 0.82 KDM4E (0.46) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL28642174 0.81 CYP3A4 (0.56) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL3287680 0.81 ALDH1A1 (0.56) MAPTCYP3A4DRD1DRD4DRD5
SCHEMBL26217307 0.79 ADORA1 (0.55) MAPTDRD4KDM4ERAB9AMAPK1
SCHEMBL5058433 0.79 SMN1; SMN2 (0.64) MAPTCYP3A4KDM4ERAB9AMAPK1
SCHEMBL18582934 0.79 SMN1; SMN2 (0.64) MAPTCYP3A4KDM4ERAB9AMAPK1
SCHEMBL5016641 0.79 SMN1; SMN2 (0.64) MAPTCYP3A4KDM4ERAB9AMAPK1

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 6 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
EP-0004291-B1 REACTIVE MEDIUM FOR ELECTROCHROMIC DISPLAY DEVICES AND ELECTROCHROMIC DISPLAY INCLUDING SUCH REACTIVE MEDIUM International Business Machines Corporation (US) 1981-03-11 EP disclosed
EP-0004291-A2 Reactive medium for electrochromic display devices and electrochromic display including such reactive medium International Business Machines Corporation (US) 1979-10-03 EP disclosed
US-4139276-A Electrochromic display devices comprising substituted fluorene compounds INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1979-02-13 US disclosed