SCHEMBL8952275

SCHEMBL8952275

C=CCCCCCCCN1CN(C)c2c1n(C)c(=O)[nH]c2=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPK10 P53779 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ EPHX2 P34913 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
SCHEMBL9118291 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL7201249 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8952197 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8802655 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL9027308 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8952345 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8952266 1.00 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8803812 0.99 HSD17B10 (0.34) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8952206 0.95 EPHX2 (0.32) HSD17B10MEN1KMT2AMAPK1HTT
SCHEMBL8952242 0.89 EPHX2 (0.33) HSD17B10MEN1KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697873-A4 — — 1996-04-03 — — EP claimed
EP-0697873-A1 OLEFIN-SUBSTITUTED LONG CHAIN COMPOUNDS CELL THERAPEUTICS, INC. (US) 1996-02-28 — — EP claimed
WO-1994015606-A1 OLEFIN-SUBSTITUTED LONG CHAIN COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-07-21 — — WO claimed
EP-0662834-A4 NOVEL EPOXIDE-CONTAINING COMPOUNDS. CELL THERAPEUTICS INC (US) 1996-04-17 — — EP disclosed
EP-0669825-A4 HYDROXYL-CONTAINING COMPOUNDS. CELL THERAPEUTICS INC (US) 1996-04-03 — — EP disclosed
EP-0697873-A4 — — 1996-04-03 — — EP disclosed
EP-0697873-A1 OLEFIN-SUBSTITUTED LONG CHAIN COMPOUNDS CELL THERAPEUTICS, INC. (US) 1996-02-28 — — EP disclosed
WO-1995026722-A1 METHOD FOR INHIBITING MAST CELL AND BASOPHIL ACTIVATION CELL THERAPEUTICS, INC. (US) 1995-10-12 — — WO disclosed
EP-0669825-A1 HYDROXYL-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1995-09-06 — — EP disclosed
EP-0662834-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1995-07-19 — — EP disclosed
WO-1994022863-A9 SECOND MESSENGER CELL SIGNALING INHIBITORS — 1994-12-22 — — WO disclosed
WO-1994015606-A1 OLEFIN-SUBSTITUTED LONG CHAIN COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-07-21 — — WO disclosed
WO-1994011001-A1 HYDROXYL-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-05-26 — — WO disclosed
WO-1994006431-A1 NOVEL EPOXIDE-CONTAINING COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-03-31 — — WO disclosed
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