Sugi Predict

Sugi Predict / Compounds / SCHEMBL4361398

SCHEMBL4361398

SCHEMBL4361398

C1=CC(Cc2ccccc2)C=CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 1/20 0.41
▸ TAAR1 Q96RJ0 2/20 0.39
▸ NOS3 P29474 1/20 0.38
▸ NOS1 P29475 1/20 0.38
▸ NOS2 P35228 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ CCR3 P51677 1/20 0.37
▸ CALM1 P0DP23 1/20 0.36

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
SCHEMBL4357593 0.83 CALM1 (0.45) GBA1CALM1
SCHEMBL4623291 0.78 CALM1 (0.41) GBA1NOS1NOS2POLBCALM1
SCHEMBL5794073 0.76 CALM1 (0.39) GBA1NOS1NOS2POLBCALM1
SCHEMBL18304984 0.74 GBA1 (0.39) GBA1POLB
SCHEMBL28453070 0.73 GBA1 (0.41) GBA1POLBCALM1
SCHEMBL6002826 0.71 CALM1 (0.39) GBA1CALM1
SCHEMBL1200483 0.70 GBA1 (0.42) GBA1POLBCCR3CALM1
SCHEMBL2027845 0.65 GBA1 (0.71) GBA1CCR3
SCHEMBL674276 0.65 GBA1 (0.71) GBA1CCR3
SCHEMBL1200566 0.65 GBA1 (0.42) GBA1POLBCCR3

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
US-8487071-B2 Polyether polymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-16 — — US disclosed
US-20110065889-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-17 — — US disclosed
WO-2009142094-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-26 — — WO disclosed