SCHEMBL7269803

SCHEMBL7269803

COc1ccc(C2(c3ccccc3F)C=Cc3c(cc(-c4ccc(C)cc4)c4ccccc34)O2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.33
ACACA Q13085 1/20 0.33
RAB9A P51151 4/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
EDNRA P25101 2/20 0.32
GPR84 Q9NQS5 1/20 0.32
NPC1 O15118 3/20 0.32
TP53 P04637 2/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GRM2 Q14416 1/20 0.31
PDK2 Q15119 1/20 0.31
ABL1 P00519 1/20 0.31
ABCB1 P08183 1/20 0.31
BCR P11274 1/20 0.31
ACP1 P24666 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
SCHEMBL7264850 0.89 TP53 (0.32) MAPTACACARAB9AKDM4EEDNRA
SCHEMBL7263814 0.86 ACACA (0.33) ACACAKDM4EEDNRASMN1; SMN2KMT2A
SCHEMBL3701217 0.82 ACACA (0.43) MAPTACACARAB9AKDM4ELMNA
SCHEMBL7122482 0.82 DPP4 (0.35) MAPTRAB9AKDM4ELMNAMAPK1
SCHEMBL14902890 0.82 KDM4E (0.32) MAPTKDM4ELMNAMAPK1SMN1; SMN2
SCHEMBL2400659 0.80 KDM4E (0.38) MAPTRAB9AKDM4ELMNAMAPK1
SCHEMBL7270823 0.79 GPR84 (0.37) RAB9AGPR84NPC1
SCHEMBL3926851 0.78 DPP4 (0.36) MAPTRAB9AKDM4ELMNAMAPK1
SCHEMBL7263818 0.74 ACACA (0.38) MAPTACACARAB9AKDM4ELMNA
SCHEMBL13219242 0.74 PDK2 (0.33) TP53PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6630597-B1 Photochromic 6-aryl substituted 3H-naphtho(2, 1-b)pyran compounds, examples of which are naphthopyran compounds having a substituted aryl group at the number 6 carbon atom and certain substituents at the 3-position of the pyran ring TRANSITIONS OPTICAL, INC. 2003-10-07 US claimed
US-10758643-B2 Mechanophoric medical product AESCULAP AG (DE) 2020-09-01 US disclosed
EP-3331581-B1 MECHANOPHORIC MEDICAL PRODUKT AESCULAP AG (DE) 2020-07-08 EP disclosed
US-20190151502-A1 Mechanophoric Medical Product AESCULAP AG (DE) 2019-05-23 US disclosed
EP-3331581-A1 MECHANOPHORIC MEDICAL PRODUCT Aesculap AG (DE) 2018-06-13 EP disclosed
WO-2017025408-A1 MECHANOPHORIC MEDICAL PRODUCT AESCULAP AG (DE) 2017-02-16 WO disclosed
US-6630597-B1 Photochromic 6-aryl substituted 3H-naphtho(2, 1-b)pyran compounds, examples of which are naphthopyran compounds having a substituted aryl group at the number 6 carbon atom and certain substituents at the 3-position of the pyran ring TRANSITIONS OPTICAL, INC. 2003-10-07 US disclosed