SCHEMBL6002973

SCHEMBL6002973

CCO[CH]C(=O)N(C1CCCCC1)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADH1A P07327 2/20 0.42
▸ ADH1C P00326 1/20 0.42
▸ TRPM8 Q7Z2W7 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ TSHR P16473 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ S1PR3 Q99500 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
SCHEMBL2093626 0.80 TRPM8 (0.48) ADH1AADH1CTRPM8MEN1KMT2A
SCHEMBL2091298 0.78 TRPM8 (0.49) ADH1AADH1CTRPM8MEN1KMT2A
SCHEMBL27206868 0.74 HTR2A (0.46) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL6002977 0.71 KMT2A (0.48) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL6003174 0.71 TRPM8 (0.43) TRPM8L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL27206290 0.71 HTR2A (0.44) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL3149066 0.71 HTR2A (0.47) ADH1AADH1CL3MBTL1MEN1KMT2A
SCHEMBL8171737 0.71 TRPM8 (0.49) ADH1AADH1CTRPM8MEN1KMT2A
SCHEMBL5545663 0.71 TRPM8 (0.56) ADH1AADH1CTRPM8MEN1KMT2A
SCHEMBL5545662 0.71 TRPM8 (0.56) ADH1AADH1CTRPM8MEN1KMT2A

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-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 — — EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 — — WO disclosed
Send feedback