SCHEMBL8540484

SCHEMBL8540484

OC1(Oc2ccccn2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
KDM4E B2RXH2 4/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
CCR1 P32246 1/20 0.35
CCR5 P51681 1/20 0.35
CCR8 P51685 1/20 0.35
METAP1 P53582 1/20 0.35
BLM P54132 1/20 0.35
HIF1A Q16665 1/20 0.35
DOHH Q9BU89 1/20 0.35
P4HTM Q9NXG6 1/20 0.35

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
SCHEMBL31432606 0.77 GRIN1 (0.33) GRIN1GRIN2AGRIN2B
SCHEMBL30500255 0.73 HSD17B10 (0.40) CHRM3KDM4ELMNACYP1A2ALDH1A1
SCHEMBL30500197 0.72 ALDH1A1 (0.40) KDM4ECYP1A2ALDH1A1HTTHPGD
SCHEMBL1701402 0.71 KDM4E (0.41) KDM4E
SCHEMBL14157582 0.68 CYP19A1 (0.38) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL4064144 0.68 OPRM1 (0.55) GRIN1GRIN2AGRIN2BCHRM2CHRM4
SCHEMBL765328 0.68 OPRM1 (0.55) GRIN1GRIN2AGRIN2BCHRM2CHRM4
SCHEMBL31221485 0.68 OPRM1 (0.55) GRIN1GRIN2AGRIN2BCHRM2CHRM4
SCHEMBL15976741 0.68 CHRM2 (0.39) GRIN1GRIN2AGRIN2BCHRM2CHRM4
SCHEMBL10957293 0.68 SLC6A4 (0.34) GRIN1GRIN2AGRIN2BLMNAGAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540697-B1 SULFONYLUREAS CIBA GEIGY AG (CH) 1998-06-03 EP disclosed
US-5625071-A HERBICIDES CIBA-GEIGY CORPORATION (US) 1997-04-29 US disclosed
US-5403814-A Preemergence and postemergence herbicides CIBA-GEIGY CORPORATION (US) 1995-04-04 US disclosed
EP-0540697-A1 NOVEL SULFONYLUREAS Novartis AG (CH) 1993-05-12 EP disclosed
WO-1992016522-A1 NOVEL SULFONYLUREAS CIBA-GEIGY AG (CH) 1992-10-01 WO disclosed