SCHEMBL9728417

SCHEMBL9728417

C1=CN(c2ccccc2)NN(Cc2ccco2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
TRPV6 Q9H1D0 1/20 0.37
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PSMD14 O00487 1/20 0.36
MMP2 P08253 1/20 0.36
DNMT1 P26358 1/20 0.36
APEX1 P27695 1/20 0.36
PTPN7 P35236 1/20 0.36
RECQL P46063 1/20 0.36
HBB P68871 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.35
ATM Q13315 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
SCHEMBL10961509 0.70 LMNA (0.44) HPGDMEN1POLBMAPTKMT2A
SCHEMBL9728348 0.69 SMN1; SMN2 (0.37) TSHRHPGDPOLBMAPTHSD17B10
SCHEMBL9728500 0.68 ADRA2A (0.46) MEN1KMT2A
SCHEMBL3192879 0.67 CFTR (0.39) L3MBTL1GAAUSP2
SCHEMBL7171966 0.64 GFER (0.59) L3MBTL1TRPV6TSHRMAPTALDH1A1
SCHEMBL27901611 0.61 ALDH1A1 (0.49) L3MBTL1TRPV6TSHRMEN1POLB
SCHEMBL9728419 0.61 L3MBTL1 (0.43) L3MBTL1TSHRHPGDPOLBMAPT
SCHEMBL1230085 0.61 CFTR (0.59) L3MBTL1TSHRHPGDMEN1KMT2A
SCHEMBL7553199 0.60 ALDH1A1 (0.56) L3MBTL1TRPV6TSHRPOLBMAPT
SCHEMBL8722265 0.59 ALDH1A1 (0.54) L3MBTL1MEN1POLBMAPTKMT2A

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
US-5098926-A Antitumor agents UNIVERSITY PATENTS, INC. (US) 1992-03-24 US disclosed
US-4888341-A 6-substituted mitomycin analogs UNIVERSITY PATENTS, INC. (US) 1989-12-19 US disclosed