Chloromethane

Chloromethane

SCHEMBL6909514

CCCCCCCCC(CCC)c1ccnc(-c2ccccn2)c1.CCCCCCCCC(CCC)c1ccnc(-c2ccccn2)c1.CCl.[Pd]

nearest known ligand 0.39

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CCR1 P32246 2/20 0.35
CCR5 P51681 2/20 0.35
CCR8 P51685 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
METAP1 P53582 1/20 0.35
BLM P54132 1/20 0.35
HIF1A Q16665 1/20 0.35
DOHH Q9BU89 1/20 0.35
P4HTM Q9NXG6 1/20 0.35
FAAH O00519 2/20 0.34
CES1 P23141 1/20 0.34

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
SCHEMBL174988 0.85 NR1I2 (0.39) CCR1CCR5CCR8KDM4E
SCHEMBL11801461 0.82 CYP1A2 (0.41) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL5974098 0.80 NR1I2 (0.47) CCR1CCR5CCR8KDM4E
SCHEMBL175672 0.79 CCR1 (0.38) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL23914094 0.76 KDM4E (0.48) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
Bromide SCHEMBL2514869 0.76 CCR1 (0.35) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
Dipyridyl SCHEMBL28135789 0.74 KDM4E (0.64) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL22458264 0.74 NR1I2 (0.37) KDM4E
SCHEMBL145233 0.74 CCR1 (0.33) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL22298873 0.74 LOXL2 (0.39) KDM4ELMNA

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-0988331-B1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH CATIONIC PALLADIUM CATALYSTS PROMERUS LLC (US) 2004-09-01 EP disclosed
US-6265506-B1 AMORPHOUS COPOLYMERS THE B. F. GOODRICH COMPANY 2001-07-24 US disclosed
EP-0988331-A1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH CATIONIC PALLADIUM CATALYSTS THE B.F. GOODRICH COMPANY (US) 2000-03-29 EP disclosed
WO-1998056839-A1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH CATIONIC PALLADIUM CATALYSTS THE B.F. GOODRICH COMPANY (US) 1998-12-17 WO disclosed