SCHEMBL9229494

SCHEMBL9229494

c1ccc(CCCCCCCCCC2OC2c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.46
CYP19A1 P11511 2/20 0.45
SLC5A2 P31639 1/20 0.44
PLA2G6 O60733 2/20 0.44
PLA2G4A P47712 1/20 0.44
SIGMAR1 Q99720 4/20 0.44
MAOA P21397 1/20 0.42
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL11825236 0.85 FASN (0.47) SLC5A2
SCHEMBL27260115 0.80 CFTR (0.45)
SCHEMBL1499434 0.80 CFTR (0.45)
SCHEMBL4624725 0.80 CFTR (0.45)
SCHEMBL379440 0.80 CFTR (0.45)
SCHEMBL9802435 0.78 SPHK1 (0.48)
SCHEMBL50937 0.76 TSHR (0.39) MAPT
SCHEMBL22109183 0.75 SIGMAR1 (0.44) FDFT1CYP19A1PLA2G6PLA2G4ASIGMAR1
SCHEMBL10766175 0.74 S1PR3 (0.47) SLC5A2
SCHEMBL8085946 0.73 SIGMAR1 (0.71) SIGMAR1MAOAMAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200157415-A1 PROPPANT TREATMENT AND ENHANCED WATER IMBIBITION IN TIGHT SUBTERRANEAN FORMATIONS BY USING DENDRIMERS TRICAN WELL SERVICE LTD. (CA) 2020-05-21 US disclosed
US-5387617-A Small cell foams and blends and a process for their preparation THE DOW CHEMICAL COMPANY (US) 1995-02-07 US disclosed