SCHEMBL30462201

SCHEMBL30462201

Cc1cc(Cl)cc(Cl)c1N

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.44
CYP3A4 P08684 7/20 0.43
ALDH1A1 P00352 7/20 0.43
TSHR P16473 4/20 0.43
TP53 P04637 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
CYP1A1 P04798 1/20 0.41
CYP1A2 P05177 1/20 0.41
AHR P35869 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.37
GAA P10253 3/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 2/20 0.35
GLA P06280 2/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL203098 1.00 CD44 (0.44) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL203946 0.86 CYP3A4 (0.58) CD44CYP3A4ALDH1A1TSHRTP53
Hydrochloric Acid SCHEMBL4006326 0.83 CYP3A4 (0.55) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL657760 0.80 ALDH1A1 (0.65) CYP3A4ALDH1A1TSHRTP53AHR
SCHEMBL525350 0.79 CYP3A4 (0.65) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL31213263 0.79 CYP3A4 (0.52) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL1196837 0.79 CYP3A4 (0.52) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL698002 0.79 KDM4E (0.45) CD44CYP3A4ALDH1A1TSHRTP53
SCHEMBL1392591 0.79 CYP3A4 (0.65) CD44CYP3A4ALDH1A1TSHRTP53
Hydrochloric Acid SCHEMBL11784583 0.77 ALDH1A1 (0.61) CYP3A4ALDH1A1TSHRTP53AHR

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-119330851-A Preparation method of 2-amino-5-chloro-N, 3-dimethylbenzamide 江西天戌药业有限公司 2025-01-21 CN disclosed
CN-115583895-B Synthetic method of 2-amino-5-chloro-N, 3-dimethylbenzamide 苏州开元民生科技股份有限公司 2023-04-07 CN disclosed