SCHEMBL9209529

SCHEMBL9209529

CN(CCc1ccccc1)C1CCN(C(=O)c2ccc(-c3nc[nH]n3)c(O)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHIA Q9BZP6 1/20 0.43
DRD4 P21917 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
MGLL Q99685 2/20 0.38
GRIN2B Q13224 1/20 0.38
FAAH O00519 1/20 0.37
LMNA P02545 1/20 0.37

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
Hydrochloric Acid SCHEMBL9203459 0.93 CHIA (0.43) CHIADRD4NPC1RAB9AL3MBTL1
Hydrochloric Acid SCHEMBL9211068 0.90 ROCK2 (0.45) CHIAMEN1KMT2A
SCHEMBL9200832 0.89 CYP11B1 (0.41) CHIADRD4MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL9202408 0.89 CHIA (0.45) CHIADRD4NPC1RAB9AL3MBTL1
SCHEMBL9202385 0.88 HTT (0.48) CHIAMEN1KMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL9212196 0.88 CHIA (0.40) CHIADRD4NPC1RAB9AL3MBTL1
SCHEMBL9210225 0.87 CHIA (0.46) CHIAKMT2AL3MBTL1L3MBTL3ABL1
Hydrochloric Acid SCHEMBL9205634 0.86 CHIA (0.43) CHIANPC1RAB9AL3MBTL1ABL1
SCHEMBL9209130 0.85 CHIA (0.43) CHIAMEN1KMT2AL3MBTL1L3MBTL3
Hydrochloric Acid SCHEMBL9208982 0.84 CHIA (0.41) CHIAMEN1KMT2AL3MBTL1ABL1

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