SCHEMBL9019380

SCHEMBL9019380

O=CCc1c(-c2ccccc2)oc2ccccc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 1/20 0.60
▸ KMT2A Q03164 4/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ CYP3A4 P08684 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ CA1 P00915 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ CA12 O43570 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ ABCB1 P08183 1/20 0.56
▸ CALM1 P0DP23 1/20 0.56
▸ AR P10275 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ CYP1B1 Q16678 1/20 0.56
▸ CA9 Q16790 1/20 0.56
▸ ADORA3 P0DMS8 1/20 0.56
▸ CYP19A1 P11511 2/20 0.54

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
SCHEMBL30672824 0.87 KMT2A (0.55) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL8630309 0.84 KMT2A (0.52) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL31511844 0.83 KMT2A (0.51) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL623887 0.83 VKORC1 (0.59) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL19846946 0.81 KMT2A (0.64) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL19846957 0.81 DDR2 (0.64) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL5178618 0.81 ABCG2 (0.60) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL18079061 0.81 KMT2A (0.59) DDR2KMT2AKDM4EMEN1CYP3A4
SCHEMBL31319016 0.81 ABCG2 (0.60) DDR2KMT2AKDM4EMEN1CYP3A4
Hydrochloric Acid SCHEMBL28357397 0.80 DDR2 (0.62) DDR2KMT2AKDM4EMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450588-B1 Substituted 3-thia- or 3-oxa-alkyl flavones, process for their preparation, their application and drugs based on these compounds as well as intermediates HOECHST AG (DE) 1996-02-28 — — EP claimed
EP-0450588-A1 Substituted 3-thia- or 3-oxa-alkyl flavones, process for their preparation, their application and drugs based on these compounds as well as intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-09 — — EP claimed
EP-0450588-B1 Substituted 3-thia- or 3-oxa-alkyl flavones, process for their preparation, their application and drugs based on these compounds as well as intermediates HOECHST AG (DE) 1996-02-28 — — EP disclosed
EP-0450588-A1 Substituted 3-thia- or 3-oxa-alkyl flavones, process for their preparation, their application and drugs based on these compounds as well as intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-09 — — EP disclosed
EP-0450588-A1 Substituted 3-thia- or 3-oxa-alkyl flavones, process for their preparation, their application and drugs based on these compounds as well as intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-09 — — EP disclosed
Send feedback