SCHEMBL9807745

SCHEMBL9807745

CCCCCCCCCCCCC(C)CCC(C)CCC(C)CNCCCCN

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.45
GNAO1 P09471 1/20 0.45
GNAI1 P63096 1/20 0.45
DNM1 Q05193 8/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
EPHX1 P07099 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
RELA Q04206 3/20 0.39

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
SCHEMBL28176328 0.97 GNAI3 (0.47) GNAI3GNAO1GNAI1DNM1ALDH1A1
SCHEMBL22383716 0.88 TSHR (0.46) DNM1ALDH1A1TSHREPHX1ACE2
SCHEMBL26553450 0.88 TSHR (0.50) ALDH1A1TSHREPHX1ACE2ANPEP
SCHEMBL27283798 0.88 TSHR (0.50) ALDH1A1TSHREPHX1ACE2ANPEP
SCHEMBL11507783 0.88 TSHR (0.50) ALDH1A1TSHREPHX1ACE2ANPEP
SCHEMBL24936448 0.88 TSHR (0.50) ALDH1A1TSHREPHX1ACE2ANPEP
SCHEMBL28166103 0.86 TSHR (0.48) GNAI3GNAO1GNAI1DNM1ALDH1A1
SCHEMBL21799678 0.86 CA12 (0.43) GNAI3GNAO1GNAI1DNM1ALDH1A1
SCHEMBL21799485 0.86 CA12 (0.43) GNAI3GNAO1GNAI1DNM1ALDH1A1
SCHEMBL21800006 0.86 CA12 (0.43) GNAI3GNAO1GNAI1DNM1ALDH1A1

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-0323163-B1 SHIFT-FEEL DURABILITY ENHANCEMENT ETHYL PETROLEUM ADDITIVES, INC. (US) 1991-05-29 EP disclosed
EP-0323163-A1 Shift-feel Durability enhancement ETHYL PETROLEUM ADDITIVES, INC. (US) 1989-07-05 EP disclosed
US-4795583-A FRICTION MODIFIER FOR AUTOMATIC TRANSMISSION FLUIDS CONTAINING AN ALIPHATIC TERTIARY AMINE, ALIPHATIC DIAMINE AND-OR N-SUBSTITUTED DIALKANOLAMINE ETHYL PETROLEUM ADDITIVES, INC. (US) 1989-01-03 US disclosed