SCHEMBL11037394

SCHEMBL11037394

CN(C)c1ccc(Br)c(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
TSHR P16473 5/20 0.50
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TERT O14746 1/20 0.44
APP P05067 1/20 0.44
MAPK1 P28482 3/20 0.40
CYP3A4 P08684 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
RAB9A P51151 1/20 0.38
CRHR1 P34998 2/20 0.38
APAF1 O14727 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
SCHEMBL13990193 0.82 ALDH1A1 (0.48) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL9939716 0.80 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL8644984 0.80 CRHR1 (0.46) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1883344 0.80 MAPT (0.47) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL23885550 0.78 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL30053767 0.78 ALDH1A1 (0.46) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL30016960 0.78 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1077214 0.78 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL28537509 0.78 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10TERT
SCHEMBL1076934 0.78 ALDH1A1 (0.43) ALDH1A1TSHRALOX15HSD17B10TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110981702-B Efficient synthesis method of 2, 3-dibromophenol or derivatives thereof 上海应用技术大学 2022-10-14 CN claimed
CN-110981702-A Efficient synthesis method of 2, 3-dibromophenol or derivatives thereof 上海应用技术大学 2020-04-10 CN claimed
JP-59181292-A None JP disclosed
CN-110981702-B Efficient synthesis method of 2, 3-dibromophenol or derivatives thereof 上海应用技术大学 2022-10-14 CN disclosed
CN-110981702-A Efficient synthesis method of 2, 3-dibromophenol or derivatives thereof 上海应用技术大学 2020-04-10 CN disclosed
JP-S59181292-A COMPOUND ABSORBING NEAR INFRARED RAY TEIKOKU CHEM IND CORP LTD 1984-10-15 JP disclosed