SCHEMBL13622273

SCHEMBL13622273

CCCCOC(=O)CNP(=O)(Cl)Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.44
POLB P06746 1/20 0.42
HDAC3 O15379 1/20 0.42
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LTA4H P09960 2/20 0.41
FAAH O00519 2/20 0.41

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
SCHEMBL13875648 0.87 BTN3A1 (0.56) BTN3A1TSHRLTA4H
SCHEMBL5019769 0.86 LMNA (0.46) BTN3A1POLBTSHRTDP1L3MBTL1
SCHEMBL14044811 0.82 BTN3A1 (0.53) BTN3A1POLBL3MBTL1MEN1KMT2A
SCHEMBL1273568 0.81 BTN3A1 (0.49) BTN3A1TDP1
SCHEMBL13875657 0.80 ALDH1A1 (0.47) L3MBTL1MEN1KMT2A
SCHEMBL21581139 0.79 BTN3A1 (0.40) BTN3A1POLBHDAC3TSHRTDP1
SCHEMBL21158536 0.79 BTN3A1 (0.45) BTN3A1HDAC3TSHRTDP1L3MBTL1
SCHEMBL12467473 0.79 BTN3A1 (0.45) BTN3A1HDAC3TSHRTDP1L3MBTL1
SCHEMBL19650266 0.77 BTN3A1 (0.57) BTN3A1TSHRMEN1KMT2A
SCHEMBL28445426 0.77 SRC (0.46) BTN3A1TDP1L3MBTL1MEN1KMT2A

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-2009142827-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OF VIRAL INFECTION GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2009-11-26 WO disclosed