SCHEMBL4364153

SCHEMBL4364153

C[CH]C(=O)OCCCCCCC

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.63
ATM Q13315 1/20 0.59
NAAA Q02083 1/20 0.57
TSHR P16473 5/20 0.55
HPGD P15428 1/20 0.55
EPHX1 P07099 1/20 0.53
ALDH1A1 P00352 2/20 0.50
CYP3A4 P08684 1/20 0.50
RAD52 P43351 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
FAAH O00519 1/20 0.47
LMNA P02545 1/20 0.47
ACHE P22303 4/20 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
SCHEMBL8376821 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL8379400 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL1245209 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL4371063 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL5239452 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL4369309 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL5238456 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL697992 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL8390518 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD
SCHEMBL8378847 1.00 HCAR2 (0.63) HCAR2ATMNAAATSHRHPGD

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
WO-2009019173-A1 OXIME ESTER PHOTOINITIATORS BASF SE (CH) 2009-02-12 WO disclosed
US-7132467-B2 Stabilization of polyolefins in permanent contact with chlorinated water CIBA SPECIALTY CHEMICALS CORP. (US) 2006-11-07 US disclosed
US-20050148700-A1 Stabilization of polyolefins in permanent contact with chlorinated water CIBA SPECIALTY CHEMICALS CORP. 2005-07-07 US disclosed
EP-1055712-B1 Aqueous ink for ink jet recording MITSUI CHEMICALS INC (JP) 2005-02-16 EP disclosed
EP-1470183-A2 STABILIZATION OF POLYOLEFINS IN PERMANENT CONTACT WITH CHLORINATED WATER Ciba SC Holding AG (CH) 2004-10-27 EP disclosed
WO-2003064511-A2 STABILIZATION OF POLYOLEFINS IN PERMANENT CONTACT WITH CHLORINATED WATER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-08-07 WO disclosed
EP-1055712-A2 Aqueous ink for ink jet recording Mitsui Chemicals, Inc. (JP) 2000-11-29 EP disclosed
US-5986042-A Cross-linked polymer MITSUI CHEMICALS, INC. (JP) 1999-11-16 US disclosed
EP-0856539-A1 Cross-linked polymer Mitsui Chemicals, Inc. (JP) 1998-08-05 EP disclosed
US-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed
EP-0523543-B1 Chiral piperazine derivatives HOFFMANN LA ROCHE (CH) 1996-02-07 EP disclosed
US-5374701-A Crosslinkable polymers of high strength free of structural defects HAY ALLAN S (CA) 1994-12-20 US disclosed
US-5356559-A Optically active piperazinyl derivatives as liquid crystals HOFFMANN-LA ROCHE INC. (US) 1994-10-18 US disclosed
EP-0523543-A1 Chiral piperazine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1993-01-20 EP disclosed