SCHEMBL6587136

SCHEMBL6587136

Cc1cc(Br)ccc1-c1ccc2c(c1)CCO2

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.46
FABP4 P15090 3/20 0.44
MAPT P10636 4/20 0.42
NPC1 O15118 3/20 0.42
KDM4E B2RXH2 1/20 0.42
RAB9A P51151 3/20 0.42
ERN1 O75460 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
FFAR1 O14842 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
BLM P54132 1/20 0.39
PRKCI P41743 1/20 0.39
CLK1 P49759 1/20 0.38
PI4K2A Q9BTU6 1/20 0.38

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
SCHEMBL155111 0.79 MAPT (0.53) DYRK1AMAPTNPC1KDM4ERAB9A
SCHEMBL29584634 0.79 MAPT (0.53) DYRK1AMAPTNPC1KDM4ERAB9A
SCHEMBL7839082 0.77 MAPT (0.52) DYRK1AMAPTNPC1KDM4ERAB9A
SCHEMBL6590522 0.77 ALOX5 (0.47) MAPTNPC1KDM4ERAB9ASMN1; SMN2
SCHEMBL8187712 0.75 DYRK1A (0.54) DYRK1AFABP4MAPTNPC1KDM4E
SCHEMBL30640621 0.75 DYRK1A (0.54) DYRK1AFABP4MAPTNPC1KDM4E
SCHEMBL6586461 0.75 CHEK1 (0.44) DYRK1AFABP4BRD4CREBBP
SCHEMBL19188073 0.73 DYRK1A (0.58) DYRK1AFABP4MAPTNPC1KDM4E
SCHEMBL679627 0.71 ESR2 (0.42) NPC1RAB9ASMN1; SMN2
SCHEMBL30414134 0.71 ESR2 (0.42) NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036062-B1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LTD (GB) 2004-01-02 EP disclosed
US-6495568-B1 TREATMENT OF TISSUE ULCERATION, WOUND REPAIR AND SKIN DISEASES WARNER-LAMBERT COMPANY 2002-12-17 US disclosed
EP-1036062-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS Pfizer Limited (GB) 2000-09-20 EP disclosed
WO-1999029667-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LIMITED (GB) 1999-06-17 WO disclosed