SCHEMBL6558522

SCHEMBL6558522

CC(C)(C)c1ccc2c3c(ccc2c1)OP(=O)(O)Oc1ccc2cc(C(C)(C)C)ccc2c1-3

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 18/20 0.58
NR1I2 O75469 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.34

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
SCHEMBL6557260 0.80 GPR84 (0.62) GPR84MEN1KMT2AKDM4E
SCHEMBL297640 0.77 GPR84 (0.62) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL6557567 0.77 GPR84 (0.58) GPR84MEN1KMT2AKDM4E
SCHEMBL6557403 0.77 GPR84 (0.58) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL6557250 0.74 GPR84 (0.56) GPR84MEN1KMT2AKDM4E
SCHEMBL6557278 0.73 GPR84 (1.00) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL3921358 0.73 GPR84 (0.58) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL297439 0.73 GPR84 (0.69) GPR84MEN1KMT2AKDM4E
SCHEMBL296014 0.73 GPR84 (1.00) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL6557609 0.71 GPR84 (0.52) GPR84KDM4E

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
EP-1038877-B1 Binaphthol monophosphoric acid derivative and its use TOSOH CORP (JP) 2004-03-10 EP disclosed
US-6274745-B1 CATALYST TOSOH CORPORATION (JP) 2001-08-14 US disclosed
EP-1038877-A1 Binaphthol monophosphoric acid derivative and its use Tosoh Corporation (JP) 2000-09-27 EP disclosed