SCHEMBL21799654

SCHEMBL21799654

CC(C)CC(C)NCCCCCCCCCCCN

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.38
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA3 P07451 3/20 0.37
CA4 P22748 3/20 0.37
CA6 P23280 3/20 0.37
CA5A P35218 3/20 0.37
CA7 P43166 3/20 0.37
CA9 Q16790 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA5B Q9Y2D0 3/20 0.37
TSHR P16473 2/20 0.37
F13A1 P00488 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
ALOX15 P16050 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 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
SCHEMBL21799955 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799491 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799621 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799922 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799629 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799680 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799962 1.00 PAOX (0.38) PAOXCA12CA1CA2CA3
SCHEMBL21799843 0.98 CA12 (0.39) PAOXCA12CA1CA2CA3
SCHEMBL21799970 0.91 CASP2 (0.36) CA12CA1CA2CA3CA4
SCHEMBL4788706 0.89 SIGMAR1 (0.42) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3623398-B1 RESIN COMPOSITION COMPRISING A MODIFIED BLOCK COPOLYMER AND METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER ASAHI CHEMICAL IND (JP) 2024-08-28 EP disclosed
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