(Chloromethyl)Benzene

(Chloromethyl)Benzene

SCHEMBL27616626

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

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 2/20 0.44
PLA2G10 O15496 1/20 0.44
PLA2G2A P14555 1/20 0.44
ALDH1A1 P00352 4/20 0.42
NOS2 P35228 2/20 0.41
ALPI P09923 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41
SLC7A5 Q01650 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
AKR1B1 P15121 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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 SCHEMBL18894568 0.88 ALDH1A1 (0.45) TDP1LMNAALDH1A1ALPIPKM
(Chloromethyl)Benzene SCHEMBL27525410 0.88 ALDH1A1 (0.48) LMNAPLA2G10PLA2G2AALDH1A1NOS2
(Chloromethyl)Benzene SCHEMBL27959241 0.88 ALDH1A1 (0.48) LMNAPLA2G10PLA2G2AALDH1A1NOS2
(Chloromethyl)Benzene SCHEMBL27536376 0.83 PLA2G10 (0.48) TDP1LMNAPLA2G10PLA2G2AALDH1A1
(Chloromethyl)Benzene SCHEMBL27410445 0.83 ALDH1A1 (0.52) TDP1LMNAALDH1A1ALPIPKM
(Chloromethyl)Benzene SCHEMBL27562557 0.83 ALDH1A1 (0.52) TDP1LMNAALDH1A1ALPIPKM
(Chloromethyl)Benzene SCHEMBL28662809 0.83 CA2 (0.48) LMNAALDH1A1ALPIPKMPTGS1
(Chloromethyl)Benzene SCHEMBL27776750 0.82 IDO1 (0.44) TDP1LMNAPLA2G10PLA2G2AALDH1A1
Benzylamine SCHEMBL28448416 0.82 LOXL2 (0.56) TDP1LMNAPLA2G10PLA2G2AALDH1A1
(Chloromethyl)Benzene SCHEMBL28290709 0.80 ALDH1A1 (0.52) LMNAALDH1A1TSHRCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1625631-A Process for manufacturing paper AKZO NOBEL NV (NL) 2005-06-08 CN disclosed