SCHEMBL7115158

SCHEMBL7115158

CCC(N=NC(CC)c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.61
NOS3 P29474 1/20 0.57
NOS2 P35228 1/20 0.57
LMNA P02545 2/20 0.50
HKDC1 Q2TB90 1/20 0.39
TRPA1 O75762 1/20 0.39
TAAR1 Q96RJ0 4/20 0.39
HTR2A P28223 3/20 0.39
HRH1 P35367 2/20 0.39
AOC3 Q16853 1/20 0.38
CYP2C19 P33261 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL7097516 0.85 MIF (0.61) MIFNOS3NOS2LMNAHKDC1
SCHEMBL27557140 0.83 MIF (0.50) MIFNOS3NOS2LMNAHKDC1
SCHEMBL919175 0.83 MIF (0.59) MIFNOS3NOS2LMNAHKDC1
SCHEMBL2404477 0.83 MIF (0.59) MIFNOS3NOS2LMNAHKDC1
SCHEMBL9921621 0.81 MIF (0.57) MIFNOS3NOS2LMNAHKDC1
SCHEMBL13594117 0.81 MIF (0.57) MIFNOS3NOS2LMNAHKDC1
SCHEMBL28118844 0.78 MIF (0.53) MIFNOS3NOS2LMNAHKDC1
SCHEMBL727626 0.76 MIF (0.67) MIFNOS3NOS2LMNAHKDC1
SCHEMBL2766612 0.76 MIF (0.67) MIFNOS3NOS2LMNAHKDC1
SCHEMBL3915370 0.76 MIF (1.00) MIFNOS3NOS2LMNAHKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562881-B2 An alkoxylate adduct of a polyol. The polyol is an amorphous diol having a melting point above about 100 degrees C. The alkoxylate is propylene oxide, butylene oxide, a mixture of propylene oxide and butylene oxide or a mixture of one or both HENKEL LOCTITE CORPORATION 2003-05-13 US disclosed
US-20030060588-A1 Liquified polyols, urethane acrylate resins prepared therewith and curable compositions employing such resins HENKEL LOCTITE CORPORATION 2003-03-27 US disclosed
EP-0884355-B1 Polyolefin foams with fine cells BOREALIS GMBH (AT) 2002-07-17 EP disclosed
EP-1211284-A1 Semi-finished products or moulded materials of improved toughness made from propylene polymers Borealis GmbH (AT) 2002-06-05 EP disclosed
US-6136926-A CURING WITH ETHYLENICALLY UNSATURATED ORGANOSILANE COMPOUND; HEATING BELOW SOFTENING POINT BOREALIS GMBH (AT) 2000-10-24 US disclosed
US-5929127-A Fine-celled polyolefin foam materials BOREALIS AG (AT) 1999-07-27 US disclosed
EP-0884355-A1 Polyolefin foams with fine cells PCD Polymere AG (AT) 1998-12-16 EP disclosed
EP-0821018-A2 Crosslinkable olefinic polymers and method for their preparation PCD-Polymere Gesellschaft m.b.H. (AT) 1998-01-28 EP disclosed
EP-0792894-A2 Continuous modification of polyolefins in solid phase PCD-Polymere Gesellschaft m.b.H. (AT) 1997-09-03 EP disclosed
US-4156764-A Poly(hydroxy) telechelic styrene polymer process GENERAL ELECTRIC COMPANY (US) 1979-05-29 US disclosed
US-4146697-A POLY(ORGANOSILOXY) TELECHELIC STYRENE POLYMER PROCESS GENERAL ELECTRIC COMPANY (US) 1979-03-27 US disclosed
US-3970612-A BULK POLYMERIZATION HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1976-07-20 US disclosed