SCHEMBL7656380

SCHEMBL7656380

CC(O)c1cccc(C2OC=CO2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
UGT2B7 P16662 1/20 0.39
BRD4 O60885 1/20 0.39
BRD2 P25440 1/20 0.39
CREBBP Q92793 1/20 0.39
EPHX1 P07099 2/20 0.37
LMNA P02545 3/20 0.36
KDM4E B2RXH2 1/20 0.34
PTPN5 P54829 1/20 0.33
CDK8 P49336 1/20 0.33
ADRB1 P08588 1/20 0.33
MIF P14174 1/20 0.33
HTR2A P28223 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
GRM7 Q14831 1/20 0.32
TSHR P16473 1/20 0.31
NOX1 Q9Y5S8 1/20 0.31
ANXA2 P07355 1/20 0.31

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
SCHEMBL6935557 0.81 LMNA (0.47) LMNAKDM4EADRB1ADRA1ATSHR
SCHEMBL7071503 0.78 EPHX1 (0.31) EPHX1
SCHEMBL31085235 0.74 LMNA (0.44) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL9331663 0.73 UGT2B7 (0.56) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL2812852 0.73 UGT2B7 (0.56) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL9334664 0.73 UGT2B7 (0.56) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL9331659 0.73 UGT2B7 (0.56) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL24081423 0.73 MEN1 (0.41) KMT2AMEN1UGT2B7BRD4BRD2
SCHEMBL921104 0.71 ALDH1A1 (0.46) KMT2AMEN1LMNAKDM4EHTR2A
SCHEMBL26998957 0.69 LMNA (0.41) KMT2AMEN1UGT2B7BRD4BRD2

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-6342613-B1 REACTING PYROCATECHOL WITH DIHALO- OR DI-ALKOXYALKANE, ACYLATING BENZO(1,3)DIOXOLE DERIVATIVE FORMED IN PRESENCE OF CATALYST, REDUCING TO 5-(ALPHA-HYDROXYALKYL)BENZO(1,3)DIOXOLE ENDURA S.P.A. (IT) 2002-01-29 US disclosed
EP-1140894-A1 PROCESS FOR THE SYNTHESIS OF 5-(ALPHA -HYDROXYALKYL) BENZO 1, 3]DIOXOLS ENDURA S.p.A. (IT) 2001-10-10 EP disclosed
WO-2000040575-A1 PROCESS FOR THE SYNTHESIS OF 5-(α -HYDROXYALKYL) BENZO[1, 3]DIOXOLS ENDURA S.P.A. (IT) 2000-07-13 WO disclosed