SCHEMBL9423965

SCHEMBL9423965

COCCN(CCOC)c1ccccc1NC(N)=S

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 3/20 0.39
TP53 P04637 1/20 0.39
ATM Q13315 1/20 0.39
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL30356288 0.80 L3MBTL1 (0.49) KMT2AALDH1A1L3MBTL1MEN1TP53
Iodide SCHEMBL9424871 0.76 KMT2A (0.40) KMT2AALDH1A1LMNAL3MBTL1MEN1
SCHEMBL30356302 0.74 L3MBTL1 (0.53) KMT2AALDH1A1L3MBTL1MEN1TP53
SCHEMBL7814232 0.74 L3MBTL1 (0.53) KMT2AALDH1A1L3MBTL1MEN1TP53
SCHEMBL11144881 0.74 TSHR (0.45) KMT2AALDH1A1LMNAMEN1TP53
SCHEMBL9424150 0.71 KMT2A (0.38) KMT2AALDH1A1LMNAMEN1TP53
SCHEMBL11166274 0.69 L3MBTL1 (0.47) KMT2AALDH1A1L3MBTL1MEN1TP53
SCHEMBL7593748 0.69 L3MBTL1 (0.71) KMT2AALDH1A1LMNAL3MBTL1MEN1
SCHEMBL16119538 0.68 HTR7 (0.50) ALDH1A1LMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL9763218 0.67 CA1 (0.44) KMT2AALDH1A1MEN1TP53SMN1; SMN2

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-5373008-A Phenylamidine and phenylguanidine derivatives and their use as anti-diabetic agents THE BOOTS COMPANT PLC. (GB) 1994-12-13 US disclosed