SCHEMBL8032807

SCHEMBL8032807

OCc1nnc(Sc2nc(-c3ccc(Cl)cc3)cs2)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
MAPT P10636 5/20 0.45
ALDH1A1 P00352 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GAA P10253 1/20 0.45
LMNA P02545 4/20 0.41
RAB9A P51151 7/20 0.41
NPC1 O15118 6/20 0.41
ALOX15 P16050 2/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
LTA4H P09960 1/20 0.40
ABL1 P00519 1/20 0.39
PLAU P00749 1/20 0.39
C1S P09871 1/20 0.39

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
SCHEMBL8048496 0.90 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8042990 0.87 RAB9A (0.47) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8044700 0.86 RAB9A (0.48) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8047850 0.85 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8032967 0.85 RAB9A (0.48) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8042084 0.84 ALDH1A1 (0.49) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8048093 0.84 RAB9A (0.43) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8048236 0.84 MAPT (0.44) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8042877 0.83 HDAC6 (0.44) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL8044404 0.82 ATM (0.44) MEN1KMT2AMAPTALDH1A1L3MBTL1

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-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed