SCHEMBL13875465

SCHEMBL13875465

COCCC(COC)NC(=O)C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
TAS1R3 Q7RTX0 3/20 0.42
TAS1R1 Q7RTX1 3/20 0.42
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NAMPT P43490 1/20 0.40
TSHR P16473 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 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
SCHEMBL13531416 0.73 HPGD (0.73) HPGDKMT2AMEN1POLBTDP1
SCHEMBL7660846 0.73 F10 (0.52) HPGDKMT2AMEN1TAS1R3TAS1R1
SCHEMBL10657344 0.72 CTSL (0.50) HPGDPOLBTDP1CA12CA1
SCHEMBL10657345 0.72 CTSL (0.50) HPGDPOLBTDP1CA12CA1
SCHEMBL13875459 0.72 MEN1 (0.52) HPGDKMT2AMEN1TSHRCES2
SCHEMBL13875451 0.72 CES1 (0.42) HPGDKMT2AMEN1TDP1TSHR
SCHEMBL29967970 0.71 ALOX5 (0.46) KMT2APOLBTSHR
SCHEMBL13753673 0.70 HPGD (0.68) HPGDKMT2AMEN1POLBNAMPT
SCHEMBL12018317 0.70 CES2 (0.52) HPGDTDP1TSHRCES2CES1
SCHEMBL9388831 0.69 SMN1; SMN2 (0.47) HPGDKMT2AMEN1TDP1TSHR

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-20090092768-A1 Process for the Production of Strongly Adherent Coatings CIBA SPECIALTY CHEMICALS CORP. 2009-04-09 US disclosed