SCHEMBL23637109

SCHEMBL23637109

CCOC(O)CCn1ccc2c(Cl)ncnc21

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.36
FGFR4 P22455 2/20 0.36
SLC22A12 Q96S37 1/20 0.35
PRMT5 O14744 3/20 0.33
WDR77 Q9BQA1 3/20 0.33
KMT2A Q03164 1/20 0.32
PKM P14618 1/20 0.32
FDPS P14324 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NOTUM Q6P988 1/20 0.31
ENPP1 P22413 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
SCHEMBL10389968 0.79 FGFR1 (0.36) FGFR1FGFR4SLC22A12PRMT5WDR77
SCHEMBL21822975 0.78 ADORA2A (0.41) FGFR1FGFR4SLC22A12NOTUM
SCHEMBL23193094 0.78 FGFR1 (0.39) FGFR1FGFR4SLC22A12PRMT5WDR77
SCHEMBL3401964 0.75 TNF (0.45) FGFR1FGFR4SLC22A12KMT2A
SCHEMBL4255524 0.75 SLC22A12 (0.41) FGFR1FGFR4SLC22A12KMT2AALDH1A1
SCHEMBL100735 0.74 SLC22A12 (0.37) FGFR1FGFR4SLC22A12PRMT5WDR77
SCHEMBL7024298 0.74 FGFR1 (0.38) FGFR1FGFR4SLC22A12KMT2AALDH1A1
SCHEMBL27849552 0.72 KDM4E (0.44) FGFR1FGFR4SLC22A12NOTUM
SCHEMBL4015921 0.72 FGFR1 (0.40) FGFR1FGFR4SLC22A12NOTUM
SCHEMBL16363382 0.72 FGFR1 (0.43) FGFR1FGFR4SLC22A12PRMT5WDR77

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
EP-3536687-B1 SMALL MOLECULE MYRISTATE INHIBITORS OF BCR-ABL AND METHODS OF USE DANA FARBER CANCER INST INC (US) 2021-07-14 EP disclosed