SCHEMBL17036829

SCHEMBL17036829

C=C(C)S(=O)(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.38
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.31
CA2 P00918 2/20 0.30
CA12 O43570 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 1/20 0.30
EPHX1 P07099 1/20 0.30
GLA P06280 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
SCHEMBL13608630 0.73 NPSR1 (0.45) NPSR1GAALMNACA2CA12
SCHEMBL14015367 0.73 NPSR1 (0.40) NPSR1GAALMNACA2CA12
Trimethylammonium SCHEMBL28623969 0.71 NPSR1 (0.39) NPSR1GAALMNACA2CA12
SCHEMBL27338834 0.69 NPSR1 (0.42) NPSR1GAALMNACA2CA12
Trimethylammonium SCHEMBL28045279 0.69 NPSR1 (0.38) NPSR1GAALMNACA2CA12
SCHEMBL18663525 0.69 NPSR1 (0.40) NPSR1GAALMNACA2CA12
SCHEMBL27240 0.69 NPSR1 (0.45) NPSR1CA2EPHX1GLA
SCHEMBL27993991 0.69 NPSR1 (0.40) NPSR1LMNAEPHX1GLA
SCHEMBL16372898 0.68 NPSR1 (0.36) NPSR1GAA
Trimethylammonium SCHEMBL21268519 0.68 NPSR1 (0.41) NPSR1GAA

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-20150241771-A1 PHOTORESIST COMPOSITIONS AND METHODS OF FORMING PATTERNS USING THE SAME SNU R&DB FOUNDATION (KR) 2015-08-27 US disclosed
US-20150241771-A1 PHOTORESIST COMPOSITIONS AND METHODS OF FORMING PATTERNS USING THE SAME SNU R&DB FOUNDATION (KR) 2015-08-27 US disclosed