SCHEMBL21799649

SCHEMBL21799649

CCCCCCCCCNCc1ccccc1CN

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 14/20 0.54
CA12 O43570 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
GRIN1 Q05586 4/20 0.50
GRIN2A Q12879 4/20 0.50
BCHE P06276 4/20 0.50
ACHE P22303 4/20 0.50
CHRM4 P08173 3/20 0.50
CHRM5 P08912 3/20 0.50
CHRM1 P11229 3/20 0.50
CHRM3 P20309 3/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
TSHR P16473 1/20 0.50
THPO P40225 1/20 0.50
RECQL P46063 1/20 0.50

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
SCHEMBL21799998 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
SCHEMBL21799778 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
SCHEMBL21799871 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
SCHEMBL21800022 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
SCHEMBL21800013 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
SCHEMBL21799544 1.00 CHRM2 (0.54) CHRM2CA12CA2CA9GRIN1
Hydrochloric Acid SCHEMBL31325230 0.98 CHRM2 (0.53) CHRM2CA12CA2CA9GRIN1
SCHEMBL21799769 0.98 CHRM2 (0.51) CHRM2CA12CA2CA9GRIN1
SCHEMBL21799866 0.93 CHRM2 (0.49) CHRM2CA12CA2CA9GRIN1
SCHEMBL28363684 0.91 CHRM2 (0.46) CHRM2CA12CA2CA9GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
US-20200199282-A1 Modified Block Copolymer, Method for Producing Modified Block Copolymer, and Resin Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-06-25 US disclosed
EP-3623398-A1 MODIFIED BLOCK COPOLYMER, METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER, AND RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2020-03-18 EP disclosed