SCHEMBL14557992

SCHEMBL14557992

CCCC(C)(C)c1ccc(C(=O)c2ccc(OC(C)(C)CC)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ ALDH1A1 P00352 4/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ HTT P42858 1/20 0.30

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
SCHEMBL14557892 0.87 ELANE (0.34) ELANESMN1; SMN2HSD17B10ALDH1A1KMT2A
SCHEMBL14557906 0.85 ELANE (0.33) ELANESMN1; SMN2NPC1RAB9AHSD17B10
SCHEMBL14557993 0.85 MAPK1 (0.33) TSHRLMNAMAPK1HTT
SCHEMBL12807721 0.83 SMN1; SMN2 (0.36) SMN1; SMN2NPC1USP2RAB9AHSD17B10
SCHEMBL10066813 0.81 CASP1 (0.36) SMN1; SMN2NPC1USP2RAB9AHSD17B10
SCHEMBL12807712 0.80 MEN1 (0.34) SMN1; SMN2ALDH1A1KMT2AMEN1MAPK1
SCHEMBL10066823 0.79 CASP1 (0.35) SMN1; SMN2NPC1RAB9AHSD17B10CYP2C9
SCHEMBL14364633 0.78 CNR2 (0.32) CNR2ALDH1A1KMT2ALMNAMAPT
SCHEMBL10067135 0.78 NPC1 (0.30) SMN1; SMN2NPC1USP2RAB9AHSD17B10
SCHEMBL13181466 0.77 ELANE (0.37) ELANESMN1; SMN2NPC1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066759-A1 Block copolymers and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-22 — — US disclosed
Send feedback