SCHEMBL9145353

SCHEMBL9145353

CCN(c1cc[c]c(C)c1)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
POLB P06746 3/20 0.36
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.35
HSD17B10 Q99714 2/20 0.35
RAB9A P51151 1/20 0.35
ESR1 P03372 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
ALOX15 P16050 1/20 0.32
KCNH2 Q12809 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL5157417 0.85 ESR1 (0.36) SMN1; SMN2POLBLMNARECQLHSD17B10
SCHEMBL1176871 0.78 ESR1 (0.41) SMN1; SMN2POLBLMNARECQLHSD17B10
SCHEMBL2696214 0.74 POLB (0.61) SMN1; SMN2POLBLMNARECQLHSD17B10
SCHEMBL1637760 0.74 S100B (0.47) LMNARECQLHSD17B10ALDH1A1TSHR
SCHEMBL12407129 0.72 KEAP1 (0.50) SMN1; SMN2ESR1ALDH1A1
SCHEMBL9460921 0.71 S100B (0.59) SMN1; SMN2LMNARAB9AESR1ALDH1A1
SCHEMBL8765455 0.71 IGLV6-57 (0.33) LMNAALDH1A1HTT
SCHEMBL8718883 0.71 ALDH1A1 (0.36) LMNAALDH1A1TSHR
SCHEMBL16880499 0.71 PSIP1 (0.43) SMN1; SMN2POLBRAB9AALDH1A1HTT
SCHEMBL4554082 0.70 TSHR (0.56) SMN1; SMN2POLBLMNARECQLHSD17B10

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-5470985-A Dye for optical recording media, photostability KONICA CORPORATION (JP) 1995-11-28 US disclosed