SCHEMBL27748604

SCHEMBL27748604

O=C(CCl)Cc1ccc(NCC(=O)Nc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
ALDH1A1 P00352 4/20 0.55
RAB9A P51151 2/20 0.55
LMNA P02545 2/20 0.55
MAPT P10636 2/20 0.55
ERCC1 P07992 2/20 0.54
ERCC4 Q92889 2/20 0.54
EPHX2 P34913 1/20 0.53
HDAC1 Q13547 2/20 0.49
MGLL Q99685 1/20 0.49
HTT P42858 2/20 0.49
NPC1 O15118 1/20 0.49
MITF O75030 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
RORC P51449 2/20 0.48
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46

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
SCHEMBL27748497 0.84 ALDH1A1 (0.52) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL1561387 0.81 MAPT (0.70) MEN1KMT2AALDH1A1RAB9ALMNA
Hydrochloric Acid SCHEMBL11858514 0.79 MAPT (0.68) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL31262909 0.77 ERCC1 (0.69) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL6904425 0.76 ALDH1A1 (0.46) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL10956691 0.75 MEN1 (0.63) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL28608583 0.74 EPHX2 (0.55) MEN1KMT2AALDH1A1MAPTERCC1
SCHEMBL5364516 0.74 HTT (0.59) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL28297938 0.74 KMT2A (0.49) MEN1KMT2AALDH1A1RAB9ALMNA
SCHEMBL10054999 0.74 EPHX2 (0.92) MEN1KMT2AALDH1A1RAB9AMAPT

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
CN-101336236-A Anthranilic acid derivatives useful in treating infection with hepatitis c virus WYETH CORP (US) 2008-12-31 CN disclosed