SCHEMBL5983101

SCHEMBL5983101

CCN(CC)CCc1cc(CCN(CC)CC)c(O)c(CCN(CC)CC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 2/20 0.44
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
KMT2A Q03164 1/20 0.41
MCL1 Q07820 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR1A P08908 5/20 0.41
DRD2 P14416 2/20 0.41

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
SCHEMBL11746409 0.87 MDM2 (0.40) HTR1DKDM4EMEN1ALDH1A1POLB
SCHEMBL11060318 0.85 KCNH2 (0.47) HTR1DKDM4EMEN1ALDH1A1POLB
SCHEMBL9237037 0.82 HTR2A (0.46) CYP3A4CYP2D6HSD17B10HTR2AHTR2B
SCHEMBL5982901 0.80 NOS3 (0.39) HTR1DHTR1ADRD2DRD1DRD4
SCHEMBL374864 0.79 MDM2 (0.45) HTR1AHSD17B10HRH3HTR2AHTR2B
SCHEMBL3974662 0.76 DRD3 (0.35) HTR1DKDM4EMEN1ALDH1A1POLB
SCHEMBL5674015 0.72 KDM4E (0.39) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL14279410 0.72 HSD17B10 (0.58) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL5677001 0.72 KDM4E (0.46) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL8933366 0.72 NPC1 (0.43) MAPK1HTTCYP3A4HSD17B10HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385177-B2 Reactivity drift and catalyst degradation in polyurethane foam FOAM SUPPLIES, INC. (US) 2019-08-20 US disclosed
US-20060030633-A1 Reactivity drift and catalyst degradation in polyurethane foam FOAM SUPPLIES, INC. 2006-02-09 US disclosed
US-5585412-A REACTING POLYOL, ISOCYANATE, WATER, ENCAPSULATED BLOWING AGENT, RUPTURING SHELL OF BLOWING AGENT OLIN CORPORATION (US) 1996-12-17 US disclosed
US-5328938-A Monochlorodifluoromethane as foaming agents for closed cell or semi-rigid foams BASF CORPORATION (US) 1994-07-12 US disclosed
US-5264464-A Chlorodifluoromethane BASF CORPORATION (US) 1993-11-23 US disclosed
US-5183583-A Acid blocked amine catalyst BASF CORPORATION (US) 1993-02-02 US disclosed
WO-1992019681-A1 PROCESS FOR PRODUCING AN ANTIMICROBIALLY EFFECTIVE POLYURETHANE OLIN CORPORATION (US) 1992-11-12 WO disclosed
WO-1992019670-A1 ON-SITE GENERATION OF POLYURETHANE FOAM USING AN HCFC AS A SOLE BLOWING AGENT OLIN CORPORATION (US) 1992-11-12 WO disclosed
US-5114984-A Dissolving pyrithione salt in alkanolamine; polymerization of polyol and polyisocyanate OLIN CORPORATION (US) 1992-05-19 US disclosed
US-5112878-A Free of CFC blowing agents OLIN CORPORATION (US) 1992-05-12 US disclosed
US-4766158-A CATALYTIC REACTION OF POLYISOCYANATES AND POLYEPOXIDE OLIN CORPORATION (US) 1988-08-23 US disclosed
EP-0254097-A2 Catalyst mixtures for polyisocyanurate foam THE CELOTEX CORPORATION (US) 1988-01-27 EP disclosed
US-4710521-A SALT OF CARBOXYLIC ACIDS AND TERTIARY AMINES THE CELOTEX CORPORATION (US) 1987-12-01 US disclosed
US-4699931-A REACTING POLYISOCYANATE WITH POLYEPOXIDE-THERMAL STABILITY OLIN CORPORATION (US) 1987-10-13 US disclosed
US-4699932-A UREA-AND WATER-FREE OLIN CORPORATION (US) 1987-10-13 US disclosed
US-4126742-A High-modulus polyisocyanurate elastomers THE UPJOHN COMPANY (US) 1978-11-21 US disclosed
US-4126741-A High-modulus polyisocyanurate elastomers THE UPJOHN COMPANY (US) 1978-11-21 US disclosed