SCHEMBL8722188

SCHEMBL8722188

CCNCC(=O)NC([C]=O)=Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RECQL P46063 1/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 1/20 0.39
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
TSHR P16473 1/20 0.37
AKR1C3 P42330 1/20 0.37
LMNA P02545 4/20 0.36
TDP1 Q9NUW8 1/20 0.35
MME P08473 2/20 0.35
NPSR1 Q6W5P4 3/20 0.35
MAPT P10636 3/20 0.35
HTT P42858 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL7654774 0.85 RECQL (0.41) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL6971894 0.85 KMT2A (0.42) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL7661454 0.83 MTNR1A (0.55) RECQLALDH1A1POLBMTNR1AMTNR1B
SCHEMBL7668480 0.80 RECQL (0.40) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL7662670 0.80 RECQL (0.47) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL8099535 0.79 RECQL (0.41) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL7657111 0.79 GLA (0.40) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL7659317 0.79 CTSC (0.40) MEN1KMT2ARECQLALDH1A1POLB
SCHEMBL7660171 0.79 MEN1 (0.51) MEN1KMT2AALDH1A1POLBTSHR
SCHEMBL7664251 0.78 RECQL (0.40) MEN1KMT2ARECQLALDH1A1POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861243-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-02 EP disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed