SCHEMBL7975740

SCHEMBL7975740

CC(C)(C)OC(=O)N1CCC(=O)C(F)C1.O=C1CCN(C(=O)c2ccc(Cl)cc2)CC1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
SETD7 Q8WTS6 2/20 0.44
STS P08842 2/20 0.42
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
POLB P06746 1/20 0.41
GLA P06280 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRM5 P41594 1/20 0.40
HDAC4 P56524 1/20 0.40
ESR2 Q92731 1/20 0.40
CNR1 P21554 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
MGLL Q99685 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
SCHEMBL7127600 0.87 HSD17B10 (0.50) MEN1KMT2APOLBGLAHSD17B10
SCHEMBL255933 0.84 DDB1 (0.43) MEN1KMT2ASETD7SMN1; SMN2ESR2
SCHEMBL20564793 0.84 DDB1 (0.43) MEN1KMT2ASETD7SMN1; SMN2ESR2
SCHEMBL18897507 0.84 DDB1 (0.43) MEN1KMT2ASETD7SMN1; SMN2ESR2
SCHEMBL1256025 0.78 KMT2A (0.92) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL1963747 0.77 HPGD (0.44) MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL3985720 0.76 KMT2A (0.56) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL3068899 0.74 KMT2A (1.00) MEN1KMT2ASTSHTTSMN1; SMN2
SCHEMBL1965378 0.73 MAPT (0.49) HTTSMN1; SMN2MAPT
SCHEMBL17711779 0.72 KMT2A (0.61) MEN1KMT2ASTSHTTSMN1; 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
WO-2001058867-A2 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-08-16 WO disclosed