SCHEMBL11635781

SCHEMBL11635781

Cc1c(CBr)[n+]([O-])c2ccccc2[n+]1[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PRDX1 Q06830 1/20 0.38
ALDH1A1 P00352 9/20 0.36
HBB P68871 4/20 0.36
ATM Q13315 1/20 0.35
KMT2A Q03164 3/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.35
CASP6 P55212 1/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
S1PR4 O95977 1/20 0.35
S1PR1 P21453 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TRPA1 O75762 1/20 0.31

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
SCHEMBL21877865 0.84 PRDX1 (0.43) PRDX1ALDH1A1ATMKMT2APOLB
SCHEMBL10572445 0.81 KDM4E (0.42) KDM4ETP53SMN1; SMN2ALDH1A1HBB
SCHEMBL10574232 0.79 ATM (0.46) KDM4ETP53SMN1; SMN2ALDH1A1HBB
Mequidox SCHEMBL193980 0.79 KMT2A (0.39) KDM4ETP53SMN1; SMN2ALDH1A1HBB
SCHEMBL11806404 0.76 KDM4E (0.36) KDM4ETP53SMN1; SMN2ALDH1A1HBB
SCHEMBL11707534 0.75 MEN1 (0.39) PRDX1ALDH1A1ATMKMT2APOLB
SCHEMBL11811962 0.75 KDM4E (0.36) KDM4ETP53SMN1; SMN2ALDH1A1HBB
SCHEMBL11714078 0.73 ALDH1A1 (0.41) KDM4ETP53SMN1; SMN2PRDX1ALDH1A1
SCHEMBL14344280 0.71 KMT2A (0.54) KDM4ETP53SMN1; SMN2ALDH1A1HBB
SCHEMBL11836412 0.71 PRDX1 (0.35) KDM4ESMN1; SMN2PRDX1ALDH1A1HBB

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
US-4100284-A BACTERICIDE, ANIMAL GROWTH PROMOTER PFIZER INC. (US) 1978-07-11 US disclosed