SCHEMBL7983585

SCHEMBL7983585

Oc1cc2c(cc1O)-c1cc(O)c(O)cc1C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
FYN P06241 2/20 0.42
ADCY6 O43306 1/20 0.42
ADCY3 O60266 1/20 0.42
ADCY9 O60503 1/20 0.42
ADCY5 O95622 1/20 0.42
ADCY8 P40145 1/20 0.42
ADCY7 P51828 1/20 0.42
ADCY2 Q08462 1/20 0.42
ADCY1 Q08828 1/20 0.42
ADCY4 Q8NFM4 1/20 0.42
EGFR P00533 1/20 0.40
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
NAMPT P43490 1/20 0.35

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
SCHEMBL7983848 0.83 NPC1 (0.53) CA1CA2CA4CA6DRD2
SCHEMBL7777089 0.83 FYN (0.48) FYNADCY6ADCY3ADCY9ADCY5
SCHEMBL30525542 0.83 FYN (0.48) FYNADCY6ADCY3ADCY9ADCY5
SCHEMBL29441859 0.76 FYN (0.41) FYNADCY6ADCY3ADCY9ADCY5
SCHEMBL24064901 0.73 FYN (0.40) FYNADCY6ADCY3ADCY9ADCY5
SCHEMBL14490576 0.71 METAP1 (0.56) CA1CA2CA4CA6NAMPT
SCHEMBL18068471 0.71 BCL2 (0.45) CA1CA2CA4CA6FYN
SCHEMBL22039120 0.71 FYN (0.44) FYNDRD2DRD1DRD4MAPT
SCHEMBL29924694 0.69 ADCY6 (0.63) FYNADCY6ADCY3ADCY9ADCY5
SCHEMBL13369159 0.69 CYP3A4 (0.46) FYNADCY6ADCY3ADCY9ADCY5

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