SCHEMBL9209130

SCHEMBL9209130

CN(CCc1ccccc1)C1CCN(C(=O)c2ccc(-c3nc[nH]n3)nc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHIA Q9BZP6 1/20 0.43
GRM5 P41594 1/20 0.41
VNN1 O95497 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 2/20 0.39
PRKAB2 O43741 2/20 0.39
PRKAG1 P54619 2/20 0.39
PRKAA2 P54646 2/20 0.39
PRKAA1 Q13131 2/20 0.39
PRKAG3 Q9UGI9 2/20 0.39
PRKAG2 Q9UGJ0 2/20 0.39
PRKAB1 Q9Y478 2/20 0.39
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
LSS P48449 1/20 0.38

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
SCHEMBL9210225 0.88 CHIA (0.46) CHIAL3MBTL3L3MBTL1KMT2AABL1
Hydrochloric Acid SCHEMBL9203459 0.85 CHIA (0.43) CHIAL3MBTL3L3MBTL1ABL1RIN1
SCHEMBL9209529 0.85 CHIA (0.43) CHIAL3MBTL3L3MBTL1KMT2AABL1
Hydrochloric Acid SCHEMBL9205634 0.83 CHIA (0.43) CHIAL3MBTL1ABL1RIN1
Hydrochloric Acid SCHEMBL9209408 0.83 CHIA (0.44) CHIAL3MBTL3L3MBTL1KMT2AABL1
Hydrochloric Acid SCHEMBL9202408 0.82 CHIA (0.45) CHIAL3MBTL3L3MBTL1ABL1RIN1
Hydrochloric Acid SCHEMBL9211396 0.82 MCHR1 (0.47) L3MBTL3LSS
Hydrochloric Acid SCHEMBL9211068 0.82 ROCK2 (0.45) CHIAKMT2AMEN1
SCHEMBL7476105 0.82 RAB9A (0.49) CHIAGRM5VNN1L3MBTL3KMT2A
SCHEMBL9200832 0.81 CYP11B1 (0.41) CHIAKMT2AMEN1LSS

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
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP disclosed