SCHEMBL23790907

SCHEMBL23790907

CCC(C)(N)CCNCC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.39
GNAI3 P08754 2/20 0.37
GNAO1 P09471 2/20 0.37
GNAI1 P63096 2/20 0.37
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
CYP2D6 P10635 1/20 0.32
KDM4E B2RXH2 2/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31

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
SCHEMBL21539284 0.98 SAT1 (0.38) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL19700576 0.79 SAT1 (0.41) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL8048307 0.77 ADH1B (0.42) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL23642013 0.76 SAT1 (0.38) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL9075139 0.75 CYP1A2 (0.46) KDM4ECYP1A2POLBSIGMAR1
SCHEMBL13493228 0.72 CYP2C19 (0.38) CYP1A2
SCHEMBL5626798 0.72 SAT1 (0.50) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL24296754 0.70 SAT1 (0.48) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL11922715 0.70 SAT1 (0.48) SAT1GNAI3GNAO1GNAI1ADH1B
SCHEMBL8393600 0.70 SAT1 (0.48) SAT1GNAI3GNAO1GNAI1ADH1B

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
EP-3604321-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2022-02-09 EP disclosed
EP-3560941-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOUND INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2021-09-08 EP disclosed