SCHEMBL7766302

SCHEMBL7766302

CCCCCNC[C@H]1CC[C@H](CNCCCCC)CC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.69
GNAO1 P09471 2/20 0.69
GNAI1 P63096 2/20 0.69
SAT1 P21673 1/20 0.65
TSHR P16473 2/20 0.55
ALDH1A1 P00352 1/20 0.55
S1PR2 O95136 5/20 0.41
S1PR4 O95977 5/20 0.41
S1PR1 P21453 5/20 0.41
S1PR3 Q99500 5/20 0.41
S1PR5 Q9H228 1/20 0.41
NAAA Q02083 1/20 0.40
FAAH O00519 1/20 0.40
EPHX1 P07099 3/20 0.39
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 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
SCHEMBL1678880 1.00 GNAI3 (0.69) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL17718455 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL7767956 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL19414059 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL11541786 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL1678448 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL11539085 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL1933069 0.98 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL23468518 0.96 GNAI3 (0.70) GNAI3GNAO1GNAI1SAT1TSHR
SCHEMBL23468533 0.96 GNAI3 (0.70) GNAI3GNAO1GNAI1SAT1TSHR

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-0718281-B1 CYCLOHEXANEDIUREA DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NISSIN FOOD PRODUCTS LTD (JP) 2001-06-27 EP disclosed
EP-0718281-A1 CYCLOHEXANEDIUREA DERIVATIVE AND PROCESS FOR PRODUCING THE SAME NISSIN FOOD PRODUCTS CO., LTD. (JP) 1996-06-26 EP disclosed