Chloromethane

Chloromethane

SCHEMBL2877158

C=C(C)C(=O)NCCN(CC)CC.CCl

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
NFKB1 P19838 1/20 0.42
KCNH2 Q12809 1/20 0.42
LMNA P02545 3/20 0.41
KMT2A Q03164 2/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41
TSHR P16473 1/20 0.41
ACHE P22303 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
BLM P54132 2/20 0.41
CYP3A4 P08684 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
PMP22 Q01453 1/20 0.41
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL93180 0.96 ALDH1A1 (0.47) ALDH1A1NFKB1KCNH2LMNAKMT2A
Hydrochloric Acid SCHEMBL28937716 0.94 ALDH1A1 (0.46) ALDH1A1NFKB1KCNH2LMNAKMT2A
Acetic Acid SCHEMBL8192294 0.93 ALDH1A1 (0.44) ALDH1A1NFKB1KCNH2LMNAKMT2A
Methacrylic Acid SCHEMBL8762478 0.91 ALDH1A1 (0.43) ALDH1A1NFKB1KCNH2LMNAKMT2A
Chloromethane SCHEMBL1425450 0.89 ALDH1A1 (0.49) ALDH1A1LMNAKMT2ATSHRMAPK1
SCHEMBL7636012 0.89 ALDH1A1 (0.43) ALDH1A1NFKB1KCNH2LMNAKMT2A
SCHEMBL4460484 0.86 CA12 (0.37) ALDH1A1NFKB1KCNH2LMNAKMT2A
SCHEMBL93199 0.85 ALDH1A1 (0.51) ALDH1A1LMNAKMT2AKDM4ECYP2D6
SCHEMBL13464194 0.84 ALDH1A1 (0.36) ALDH1A1NFKB1KCNH2LMNAKMT2A
Hydrochloric Acid SCHEMBL10636930 0.84 ALDH1A1 (0.50) ALDH1A1LMNAKMT2ABLMCYP3A4

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-1584633-B1 MODIFIED POLYALLYLAMINE AND PROCESS FOR PRODUCING THE SAME NITTO BOSEKI CO LTD (JP) 2010-10-20 EP disclosed
US-7547747-B2 Modified polyallylamine and process for producing the same NITTO BOSEKI CO., LTD. (JP) 2009-06-16 US disclosed
US-20060122335-A1 Modified polyallylamine and process for producing the same NITTO BOSEKI CO., LTD. (JP) 2006-06-08 US disclosed
EP-1584633-A1 MODIFIED POLYALLYLAMINE AND PROCESS FOR PRODUCING THE SAME NITTO BOSEKI CO., LTD. (JP) 2005-10-12 EP disclosed