SCHEMBL6696698

SCHEMBL6696698

NC[Si](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.44
LOXL2 Q9Y4K0 3/20 0.42
LTA4H P09960 3/20 0.39
TSHR P16473 1/20 0.39
PLA2G2A P14555 1/20 0.39
AOC3 Q16853 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP2A6 P11509 1/20 0.39
HTR2A P28223 1/20 0.39
KCNA3 P22001 1/20 0.39
CA5A P35218 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
IDO1 P14902 1/20 0.37
HRH1 P35367 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL6698560 0.81 TAAR1 (0.46) TAAR1LOXL2LTA4HTSHRPLA2G2A
SCHEMBL329329 0.79 LTA4H (0.43) TAAR1LOXL2LTA4HTSHRSMN1; SMN2
SCHEMBL329176 0.79 LTA4H (0.43) TAAR1LTA4HTSHRSMN1; SMN2KCNA3
SCHEMBL3338614 0.78 TSHR (0.39) LOXL2LTA4HTSHRKCNA3CA5A
SCHEMBL305461 0.78 TAAR1 (0.43) TAAR1LTA4HPLA2G2AHTR2AKCNA3
SCHEMBL3402156 0.78 TAAR1 (0.43) TAAR1LOXL2LTA4HTSHRPLA2G2A
SCHEMBL3916371 0.75 LTA4H (0.39) TAAR1LTA4HTSHRSMN1; SMN2KCNA3
SCHEMBL706489 0.75 KCNA3 (0.44) TAAR1LTA4HTSHRSMN1; SMN2KCNA3
SCHEMBL431273 0.75 CA4 (0.42) LTA4HTSHRKCNA3CA5ACA5B
SCHEMBL329378 0.75 KCNA3 (0.44) TAAR1LTA4HTSHRSMN1; SMN2KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113597455-B Water-based coating composition and coated metal sheet 日本制铁株式会社 2023-01-06 CN disclosed
CN-113597455-A Coating composition and coated metal sheet 日本制铁株式会社 2021-11-02 CN disclosed
WO-2020194799-A1 COATING MATERIAL COMPOSITION AND COATED METAL SHEET 日鉄日新製鋼株式会社 2020-10-01 WO disclosed
US-20040197484-A1 Coating liquid for forming insulating film and method for producing insulating film SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-07 US disclosed
US-5017636-A Also containing polyisoprene, natural rubber, butadiene-styrene copolymer, wear and heat resistance, resilience JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-05-21 US disclosed