SCHEMBL10908712

SCHEMBL10908712

CCCCCCCCCC(=O)NSCC(OC)OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
HSP90AA1 P07900 1/20 0.47
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
DNM1 Q05193 1/20 0.42
POLB P06746 1/20 0.42
POLA1 P09884 1/20 0.42
CNR2 P34972 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
CETP P11597 1/20 0.40
LPAR1 Q92633 1/20 0.40
NOD1 Q9Y239 1/20 0.40

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
SCHEMBL14166466 0.77 HSP90AA1 (0.55) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL9860468 0.77 HSP90AA1 (0.55) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL10909670 0.77 HSP90AA1 (0.47) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL6063048 0.76 HSP90AA1 (0.54) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL28677950 0.75 CYP3A4 (0.45) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL10909147 0.74 HSP90AA1 (0.52) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL18373774 0.74 FAAH (0.55) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL14166875 0.73 HSP90AA1 (0.50) FAAHMEN1MAPK1KMT2AHSP90AA1
SCHEMBL10911251 0.72 GPR84 (0.55) MEN1KMT2AALDH1A1POLB
SCHEMBL18971148 0.72 HSP90AA1 (0.59) FAAHMEN1MAPK1KMT2AHSP90AA1

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-4618416-A COLLECTORS FOR METAL SULFIDE MINERALS; FROTH FLOATATION SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) 1986-10-21 US claimed
US-4618416-A COLLECTORS FOR METAL SULFIDE MINERALS; FROTH FLOATATION SOCIETE NATIONALE ELF AQUITAINE (PRODUCTION) (FR) 1986-10-21 US disclosed