SCHEMBL31663467

SCHEMBL31663467

O=C(CNCCc1cccc(Cl)c1)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HPGD P15428 1/20 0.54
KDM4E B2RXH2 1/20 0.53
TSHR P16473 1/20 0.53
PLAAT3 P53816 2/20 0.51
PLAAT5 Q96KN8 2/20 0.51
PLAAT2 Q9NWW9 2/20 0.51
PLAAT4 Q9UL19 2/20 0.51
CYP2D6 P10635 1/20 0.49
TAAR1 Q96RJ0 2/20 0.49
HDAC1 Q13547 1/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
HCAR2 Q8TDS4 1/20 0.48
PKM P14618 1/20 0.47
CNR1 P21554 1/20 0.46

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
Hydrochloric Acid SCHEMBL31407435 0.87 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL6676173 0.86 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1SMN1; SMN2CYP2D6
Hydrochloric Acid SCHEMBL6678335 0.84 ALDH1A1 (0.54) ALDH1A1KMT2ASMN1; SMN2CYP2D6MAPT
SCHEMBL9542924 0.83 TAAR1 (0.55) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL31370008 0.82 ALDH1A1 (0.67) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL8222658 0.81 KMT2A (0.64) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL32661915 0.81 BCHE (0.46) ALDH1A1KMT2AMEN1SMN1; SMN2CYP2D6
SCHEMBL11064961 0.80 PLAAT3 (0.52) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL31407741 0.80 BCHE (0.46) ALDH1A1KMT2AMEN1SMN1; SMN2TAAR1
SCHEMBL11686224 0.79 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD

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
CN-120349255-A Synthesis method of (3-chlorophenyl ethyl) glycine benzyl ester 吉尔多肽生物制药(大连市)有限公司 2025-07-22 CN disclosed
CN-120349255-A Synthesis method of (3-chlorophenyl ethyl) glycine benzyl ester 吉尔多肽生物制药(大连市)有限公司 2025-07-22 CN disclosed