SCHEMBL3810144

SCHEMBL3810144

CO[SiH](CCCN1CCNCC1)OC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 3/20 0.46
SIGMAR1 Q99720 3/20 0.40
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
HSD17B10 Q99714 1/20 0.34
GNAI3 P08754 3/20 0.34
GNAO1 P09471 3/20 0.34
GNAI1 P63096 3/20 0.34
KDM1A O60341 1/20 0.34

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
SCHEMBL2399870 0.94 CXCR4 (0.47) CXCR4SIGMAR1POLBSMN1; SMN2MEN1
SCHEMBL29030826 0.88 POLB (0.41) CXCR4SIGMAR1POLBSMN1; SMN2MEN1
SCHEMBL4065756 0.81 CXCR4 (0.43) CXCR4SIGMAR1POLBSMN1; SMN2HRH2
SCHEMBL4063053 0.79 CXCR4 (0.41) CXCR4SIGMAR1POLBSMN1; SMN2MEN1
SCHEMBL25570987 0.78 CXCR4 (0.50) CXCR4SIGMAR1POLBSMN1; SMN2HRH2
SCHEMBL2403147 0.77 CXCR4 (0.44) CXCR4SIGMAR1POLBSMN1; SMN2HRH2
SCHEMBL28008798 0.75 SMN1; SMN2 (0.38) CXCR4SIGMAR1POLBSMN1; SMN2MEN1
SCHEMBL14814086 0.74 PAOX (0.43) SIGMAR1MEN1KMT2AHRH3GNAI3
SCHEMBL611597 0.74 HRH3 (0.54) SIGMAR1SMN1; SMN2MEN1KMT2AHRH1
SCHEMBL4065762 0.74 CXCR4 (0.42) CXCR4SIGMAR1POLBSMN1; SMN2HRH2

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
CN-113578062-A Preparation method of durable hydrophilic uniform-pore ultrafiltration membrane 天津工业大学 2021-11-02 CN claimed
CN-113578062-B Preparation method of durable hydrophilic uniform-pore ultrafiltration membrane 天津工业大学 2022-06-17 CN disclosed
CN-113578062-A Preparation method of durable hydrophilic uniform-pore ultrafiltration membrane 天津工业大学 2021-11-02 CN disclosed
EP-1086969-B1 NOVEL POLYISOCYANATE AND METHOD FOR PRODUCING THE SAME ASAHI CHEMICAL IND (JP) 2009-08-12 EP disclosed
CN-1118500-C Novel polyisocyanate and process for producing the same ASAHI CHEMICAL IND (JP) 2003-08-20 CN disclosed
US-6469122-B1 POLYISOCYANATE OBTAINED BY REACTING A DIISOCYANATE SELECTED FROM AN ALIPHATIC DIISOCYANATE AND AN ALICYCLIC DIISOCYANATE WITH A POLYOL HAVING A NUMBER AVERAGE MOLECULAR WEIGHT OF FROM 3,000 TO 30,000; CURABLE SEALANT ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-10-22 US disclosed
CN-1293682-A Novel polyisocyanate and process for producing the same ASAHI CHEMICAL IND (JP) 2001-05-02 CN disclosed
EP-1086969-A1 NOVEL POLYISOCYANATE AND PROCESS FOR PRODUCING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2001-03-28 EP disclosed