SCHEMBL6956288

SCHEMBL6956288

CN1CCN(CCCC([O])=O)CC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.60
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.45
CYP1A2 P05177 2/20 0.45
MAPK1 P28482 1/20 0.45
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
RAD52 P43351 1/20 0.43
HTR7 P34969 2/20 0.43
RAB9A P51151 1/20 0.40
TP53 P04637 3/20 0.39
SIGMAR1 Q99720 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38

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
SCHEMBL4681280 0.83 SMN1; SMN2 (0.67) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL2091283 0.83 PAOX (0.60) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL11523231 0.83 PAOX (0.85) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
Hydrochloric Acid SCHEMBL7427001 0.81 PAOX (0.58) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
Hydrochloric Acid SCHEMBL1128155 0.81 SMN1; SMN2 (0.64) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL12412725 0.81 PAOX (0.58) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
Hydrochloric Acid SCHEMBL1127753 0.81 SMN1; SMN2 (0.64) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL1127933 0.79 PAOX (0.56) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL26528338 0.79 PAOX (0.56) PAOXTSHRSMN1; SMN2CYP1A2MAPK1
SCHEMBL11715757 0.79 PAOX (0.56) PAOXTSHRSMN1; SMN2CYP1A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765160-B1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS UNIV RAMOT (IL) 2003-04-16 EP claimed
US-6096740-A BLOCK N-METHYL-ASPARTATE RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 2000-08-01 US claimed
EP-0765160-A4 1997-04-09 EP claimed
EP-0765160-A1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS RAMOT UNIVERSITY, AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 1997-04-02 EP claimed
WO-1995020958-A1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 1995-08-10 WO claimed
EP-0765160-B1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS UNIV RAMOT (IL) 2003-04-16 EP disclosed
US-6096740-A BLOCK N-METHYL-ASPARTATE RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 2000-08-01 US disclosed
EP-0765160-A4 1997-04-09 EP disclosed
EP-0765160-A1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS RAMOT UNIVERSITY, AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 1997-04-02 EP disclosed
WO-1995020958-A1 DEXANABINOL DERIVATIVES AND THEIR USE AS NEUROPROTECTIVE PHARMACEUTICAL COMPOSITIONS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 1995-08-10 WO disclosed