SCHEMBL24296754

SCHEMBL24296754

CCCNCC1CCCCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.48
ADH1B P00325 1/20 0.46
ADH1C P00326 1/20 0.46
ADH1A P07327 1/20 0.46
ADH4 P08319 1/20 0.46
ADH7 P40394 1/20 0.46
CYP1A2 P05177 1/20 0.44
GNAI3 P08754 2/20 0.44
GNAO1 P09471 2/20 0.44
GNAI1 P63096 2/20 0.44
EPHX1 P07099 4/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 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
SCHEMBL11922715 1.00 SAT1 (0.48) SAT1ADH1BADH1CADH1AADH4
SCHEMBL8393600 1.00 SAT1 (0.48) SAT1ADH1BADH1CADH1AADH4
SCHEMBL5626798 0.98 SAT1 (0.50) SAT1ADH1BADH1CADH1AADH4
SCHEMBL26507012 0.93
Hydrochloric Acid SCHEMBL5379319 0.91 GNAI3 (0.48) SAT1ADH1BADH1CADH1AADH4
SCHEMBL95570 0.87
SCHEMBL11420212 0.87 SAT1 (0.60) SAT1GNAI3GNAO1GNAI1EPHX1
SCHEMBL842526 0.86 SAT1 (0.55) SAT1ADH1BADH1CADH1AADH4
Hydrochloric Acid SCHEMBL6609960 0.85
SCHEMBL11594234 0.85 ADH1B (0.54) SAT1ADH1BADH1CADH1AADH4

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
US-20220123290-A1 Composition for Anode of Lithium Secondary Battery and Lithium Secondary Battery Manufactured Using the Same SK ON CO., LTD. (KR) 2022-04-21 US disclosed