SCHEMBL28156554

SCHEMBL28156554

CCCCCNC(N)CCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.47
OPRM1 P35372 1/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
RRM1 P23921 1/20 0.39
TP53 P04637 1/20 0.39
DNM1 Q05193 2/20 0.39
EPHX1 P07099 2/20 0.39
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 1/20 0.37
ANPEP P15144 1/20 0.36
ERAP2 Q6P179 1/20 0.36
NOD1 Q9Y239 1/20 0.36
SPHK1 Q9NYA1 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34

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
SCHEMBL25669684 0.98 DPP7 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL10457082 0.95 OPRM1 (0.48) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL27896530 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL28161008 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL28331825 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL9163909 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL28985254 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL28542120 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL9691923 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1
SCHEMBL27296398 0.93 OPRM1 (0.46) DPP7OPRM1ALDH1A1TSHRRRM1

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
CN-106794172-A Composition for inducing cell reprogramming 光州科学技术院 2017-05-31 CN claimed