SCHEMBL21799760

SCHEMBL21799760

CCC(CC)CNCc1ccccc1CN

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
PNMT P11086 1/20 0.35
CYP2D6 P10635 2/20 0.34
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
DPP4 P27487 2/20 0.33
PIM1 P11309 1/20 0.33
DNM1 Q05193 1/20 0.33
CHRM2 P08172 2/20 0.33
CYP1A2 P05177 1/20 0.33
CA2 P00918 2/20 0.32
CA12 O43570 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL21799881 0.84 MEN1 (0.37) MEN1KMT2AALDH1A1PNMTCYP2D6
SCHEMBL21799844 0.81 CA2 (0.44) MEN1KMT2AALDH1A1PNMTCYP2D6
SCHEMBL21799542 0.79 GAA (0.46) KDM4EPNMTCYP2D6TSHRHIF1A
SCHEMBL21799869 0.79 MEN1 (0.38) MEN1KMT2AALDH1A1PNMTCYP2D6
SCHEMBL21799703 0.78 MEN1 (0.36) MEN1KMT2AALDH1A1PNMTCYP2D6
SCHEMBL21799745 0.76 SLC6A4 (0.47) ALDH1A1KDM4ETSHRCHRM2CA2
SCHEMBL21799537 0.74 ANPEP (0.51) ALDH1A1CYP2D6CYP1A2
SCHEMBL21799898 0.74 KDM4E (0.43) MEN1KMT2AALDH1A1KDM4EPNMT
SCHEMBL21799866 0.73 CHRM2 (0.49) KDM4ECYP2D6TSHRCHRM2CA2
SCHEMBL21799557 0.73 LMNA (0.42) MEN1KMT2AALDH1A1KDM4EPNMT

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