SCHEMBL7651855

SCHEMBL7651855

CCCCCCCCCCCCCCCCCCC1=NC(CCCCCCCCCCCCCCCCCC)CO1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
NOS1 P29475 3/20 0.41
NOS2 P35228 3/20 0.41
TAAR1 Q96RJ0 1/20 0.36
SCN2A Q99250 2/20 0.35
EPHX1 P07099 1/20 0.35
KCNH2 Q12809 1/20 0.34
CYP1A2 P05177 2/20 0.33
NOS3 P29474 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL7854308 1.00 ALDH1A1 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL7857240 1.00 ALDH1A1 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL7846606 1.00 ALDH1A1 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL7856874 1.00 ALDH1A1 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL7854852 1.00 ALDH1A1 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL7091189 0.98 NOS2 (0.41) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL10616856 0.97 NOS2 (0.44) ALDH1A1NOS1NOS2TAAR1SCN2A
SCHEMBL28581953 0.95 NOS2 (0.45) ALDH1A1NOS1NOS2TAAR1KCNH2
SCHEMBL28581955 0.95 NOS2 (0.45) ALDH1A1NOS1NOS2TAAR1KCNH2
SCHEMBL10491961 0.88 ALDH1A1 (0.34) ALDH1A1NOS1NOS2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6287373-B1 FOR ACOUSTIC INK JET PRINTING XEROX CORPORATION 2001-09-11 US claimed
US-6210783-B1 COMPRISED OF SUPPORTING SUBSTRATE, A HEAT DISSIPATING COATING LAYER IN CONTACT WITH SUBSTRATE, WHEREIN COATING IS COMPRISED OF A HEAT DISSIPATING BINDER, AN ANTISTATIC COMPOUND, AN INK RECEIVER COATING COMPRISING BINDER, OXAZOLINE COMPOUND XEROX CORPORATION 2001-04-03 US claimed
US-6110265-A Ink compositions XEROX CORPORATION (US) 2000-08-29 US claimed
US-6334890-B1 COMPOSITION COMPRISED OF OXAZOLINE COMPOUND WITH SPECIFIED MELTING POINT AND ACOUSTIC LOSS VALUE, LONG CHAIN CARBAMATE, ALCOHOL COMPOUND, LIGHTFASTNESS COMPONENT, LIGHTFASTNESS ANTIOXIDANT, COLORANT XEROX CORPORATION 2002-01-01 US disclosed
US-6287373-B1 FOR ACOUSTIC INK JET PRINTING XEROX CORPORATION 2001-09-11 US disclosed
US-6210783-B1 COMPRISED OF SUPPORTING SUBSTRATE, A HEAT DISSIPATING COATING LAYER IN CONTACT WITH SUBSTRATE, WHEREIN COATING IS COMPRISED OF A HEAT DISSIPATING BINDER, AN ANTISTATIC COMPOUND, AN INK RECEIVER COATING COMPRISING BINDER, OXAZOLINE COMPOUND XEROX CORPORATION 2001-04-03 US disclosed
US-6110265-A Ink compositions XEROX CORPORATION (US) 2000-08-29 US disclosed
US-6106601-A MIXTURE CONTAINING OXAZOLINE AND THIOUREA COMPOUNDS XEROX CORPORATION (US) 2000-08-22 US disclosed