SCHEMBL11276142

SCHEMBL11276142

C=CCNC(=O)COC(=O)C(C)c1ccc(OC(=O)c2ccc(NC(=N)N)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
PRSS1 P07477 3/20 0.38
ACR P10323 2/20 0.38
F7 P08709 4/20 0.37
F2 P00734 3/20 0.37
F10 P00742 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MEN1 O00255 3/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MAPT P10636 1/20 0.36
RECQL P46063 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
KLK1 P06870 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
SCHEMBL11268529 0.88 ALDH1A1 (0.43) KMT2APRSS1ACRSMN1; SMN2MEN1
SCHEMBL11273835 0.86 KMT2A (0.40) KMT2APRSS1ACRF7F2
SCHEMBL11274623 0.85 RECQL (0.49) KMT2APRSS1ACRF7F2
SCHEMBL11276133 0.85 L3MBTL1 (0.46) KMT2AF7F2MEN1ALDH1A1
SCHEMBL11272851 0.85 MGLL (0.43) KMT2APRSS1ACRSMN1; SMN2MEN1
SCHEMBL9235998 0.84 ACR (0.40) KMT2APRSS1ACRF2F10
SCHEMBL9231748 0.84 ACR (0.40) KMT2APRSS1ACRF2F10
Methane SCHEMBL9230653 0.83 KMT2A (0.41) KMT2APRSS1ACRF7F2
SCHEMBL11427664 0.83 KMT2A (0.50) KMT2APRSS1ACRSMN1; SMN2MEN1
SCHEMBL11277920 0.83 KLK7 (0.47) KMT2APRSS1F2SMN1; SMN2MEN1

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-4310533-A INHIBITING PLASMIN AND-OR TRYSIN ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 1982-01-12 US disclosed