SCHEMBL9673196

SCHEMBL9673196

CCCCCCCCCCCCCC[C@H]1C[C@H](CI)OC1=O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
LMNA P02545 1/20 0.52
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.46
CYP1A2 P05177 2/20 0.45
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL9673203 1.00 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL9673207 1.00 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL7311353 1.00 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL7442911 1.00 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL3658650 0.88 HTT (0.62) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL9450606 0.87 HTT (0.60) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL3657694 0.86 HTT (0.59) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL9450633 0.85 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL10543134 0.85 HTT (0.58) HTTSMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL9673119 0.84 HTT (0.61) HTTSMN1; SMN2LMNAALDH1A1HPGD

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
EP-0312040-B1 2,4-DISUBSTITUTED DERIVATIVES OF TETRAHYDROFURAN J. URIACH & CIA. S.A. (ES) 1992-06-03 EP disclosed
US-4997843-A Platelet activating factor, anticoagulants J URIACH & CIA S.A. (ES) 1991-03-05 US disclosed
EP-0312040-A2 2,4-Disubstituted derivatives of tetrahydrofuran J. URIACH & CIA. S.A. (ES) 1989-04-19 EP disclosed