SCHEMBL7936727

SCHEMBL7936727

NNC1CCN(C(=O)c2ccccc2)C1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 2/20 0.63
▸ ACHE P22303 1/20 0.55
▸ L3MBTL3 Q96JM7 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ EPHX2 P34913 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ SLC18A3 Q16572 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ PTPN2 P17706 1/20 0.48
▸ PTPN1 P18031 1/20 0.48
▸ MGLL Q99685 1/20 0.47
▸ HSD11B1 P28845 1/20 0.47

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
SCHEMBL2132888 0.84 EPHX1 (0.63) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL2132882 0.84 EPHX1 (0.63) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL7881494 0.84 EPHX1 (0.63) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL23573505 0.84 EPHX1 (0.68) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL2131537 0.84 EPHX1 (0.68) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL23573324 0.84 EPHX1 (0.68) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL16358910 0.82 EPHX1 (0.64) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL17875071 0.82 EPHX1 (0.78) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL12655781 0.81 EPHX1 (0.58) EPHX1ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL2131950 0.80 EPHX1 (0.57) EPHX1ACHEL3MBTL3L3MBTL1KMT2A

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
US-6245796-B1 NERVOUS SYSTEM DISORDERS; SEXUAL DISORDERS; SLEEP DISORDERS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-12 — — US disclosed
EP-0990650-A1 TRICYCLIC PYRROLE OR PYRAZOLE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2000-04-05 — — EP disclosed
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