SCHEMBL9719961

SCHEMBL9719961

CCc1ccc(Oc2ccccc2C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
CTNNB1 P35222 1/20 0.51
KDM4E B2RXH2 4/20 0.51
HSD17B10 Q99714 3/20 0.51
LMNA P02545 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
MEN1 O00255 1/20 0.51
RECQL P46063 1/20 0.51
KMT2A Q03164 1/20 0.51
AGTR1 P30556 1/20 0.51
AGTR2 P50052 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LPAR1 Q92633 3/20 0.49
LPAR3 Q9UBY5 1/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49

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
SCHEMBL17010760 0.86 ALDH1A1 (0.44) CTNNB1KDM4EHSD17B10LMNACYP1A2
SCHEMBL4160313 0.86 AGTR1 (0.59) HTTKDM4EHSD17B10LMNAMEN1
SCHEMBL28411450 0.86 CTNNB1 (0.66) HTTCTNNB1KDM4EHSD17B10LMNA
SCHEMBL17010762 0.86 KDM4E (0.50) HTTKDM4EHSD17B10LMNACYP1A2
SCHEMBL8104321 0.84 LTA4H (0.58) HTTCTNNB1KDM4EHSD17B10LMNA
SCHEMBL707627 0.84 CTNNB1 (0.51) HTTCTNNB1KDM4EHSD17B10MEN1
SCHEMBL8641931 0.84 SRD5A2 (0.58) HTTCTNNB1KDM4ELMNAKMT2A
SCHEMBL543492 0.84 PPARA (0.59) KDM4ELMNAMEN1RECQLKMT2A
SCHEMBL8646631 0.84 PPARA (0.59) KDM4ELMNAMEN1RECQLKMT2A
SCHEMBL9719824 0.83 KDM4E (0.51) HTTCTNNB1KDM4EHSD17B10LMNA

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-9017638-B2 Graphene prepared by using edge functionalization of graphite Unist Academy-Industry Research Corp (KR) 2015-04-28 US claimed
US-20130108540-A1 GRAPHENE PREPARED BY USING EDGE FUNCTIONALIZATION OF GRAPHITE UNIST ACADEMY-INDUSTRY RESEARCH CORPORATION 2013-05-02 US claimed
US-9017638-B2 Graphene prepared by using edge functionalization of graphite Unist Academy-Industry Research Corp (KR) 2015-04-28 US disclosed
US-20130108540-A1 GRAPHENE PREPARED BY USING EDGE FUNCTIONALIZATION OF GRAPHITE UNIST ACADEMY-INDUSTRY RESEARCH CORPORATION 2013-05-02 US disclosed
US-5078906-A Organic lithium-potassium complexes for metallization reactions, preparation of aspirin substitutes, fenoprofen MINE SAFETY APPLIANCES COMPANY (US) 1992-01-07 US disclosed
EP-0379987-A2 Process for the preparation of alpha-arylalkanoic acids Mine Safety Appliances Company (US) 1990-08-01 EP disclosed
US-4910337-A Process for the preparation of α-arylalkanoic acids MINE SAFETY APPLIANCES COMPANY (US) 1990-03-20 US disclosed