SCHEMBL28042597

SCHEMBL28042597

ClNc1cccc2c1OCO2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 1/20 0.47
TTBK2 Q6IQ55 1/20 0.47
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
ACVRL1 P37023 1/20 0.40
MT-CO2 P00403 1/20 0.40
ABCB1 P08183 1/20 0.39
FLT1 P17948 1/20 0.39
GSK3B P49841 1/20 0.37
ALOX5 P09917 1/20 0.37
EPHB4 P54760 2/20 0.36
EED O75530 1/20 0.36
PKM P14618 1/20 0.35
TSHR P16473 1/20 0.35
SYK P43405 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
SCHEMBL507057 0.80 TTBK1 (0.47) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL2505047 0.80 TTBK1 (0.50) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL28230659 0.76 ALDH1A1 (0.45) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL2502095 0.76 TTBK1 (0.43) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL19867355 0.76 POLB (0.45) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL12403903 0.76 TTBK1 (0.43) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL9258744 0.76 KDM4E (0.45) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL4025660 0.74 POLB (0.57) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL18893494 0.73 TTBK1 (0.45) TTBK1TTBK2POLBMAPK1ABCG2
SCHEMBL6927430 0.73 ALDH1A1 (0.49) TTBK1TTBK2POLBMAPK1ABCG2

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
CN-103275072-B The preparation method of saracatinib SUZHOU MINGYUE MEDICAL TECHNOLOGY CO., LTD. (CN) 2016-01-20 CN disclosed