(Chloromethyl)Benzene

(Chloromethyl)Benzene

SCHEMBL8973203

C=C(C(=O)O)N(C)C.ClCc1ccccc1

nearest known ligand 0.41

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
HPGD P15428 2/20 0.39
NOTUM Q6P988 1/20 0.39
KMT2A Q03164 3/20 0.39
EGFR P00533 2/20 0.39
MEN1 O00255 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
PAX8 Q06710 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 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
(Chloromethyl)Benzene SCHEMBL19066412 0.81 ALDH1A1 (0.48) HPGDKMT2AMEN1ALDH1A1SMN1; SMN2
(Chloromethyl)Benzene SCHEMBL18894568 0.81 ALDH1A1 (0.45) NPC1RAB9AKMT2AMEN1TDP1
(Chloromethyl)Benzene SCHEMBL130257 0.78 HPGD (0.43) NPC1RAB9ACA12CA9HPGD
(Chloromethyl)Benzene SCHEMBL28164357 0.77 HPGD (0.42) NPC1RAB9ACA12CA9HPGD
(Chloromethyl)Benzene SCHEMBL130258 0.77 UBE2N (0.44) NPC1RAB9AKMT2AEGFRMEN1
(Chloromethyl)Benzene SCHEMBL28396268 0.77 HPGD (0.42) NPC1RAB9ACA12CA9HPGD
(Chloromethyl)Benzene SCHEMBL27562557 0.76 ALDH1A1 (0.52) NPC1RAB9AKMT2AMEN1TDP1
(Chloromethyl)Benzene SCHEMBL27410445 0.76 ALDH1A1 (0.52) NPC1RAB9AKMT2AMEN1TDP1
(Chloromethyl)Benzene SCHEMBL196178 0.76 TSHR (0.52) NPC1RAB9ACA12CA9MAOA
(Chloromethyl)Benzene SCHEMBL998444 0.76 CES2 (0.52) NPC1RAB9AKMT2AMEN1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5536482-A Process for pollution control NALCO FUEL TECH (US) 1996-07-16 US disclosed
WO-1994008895-A1 PROCESS AND COMPOSITION FOR POLLUTION CONTROL NALCO FUEL TECH (US) 1994-04-28 WO disclosed