SCHEMBL9557069

SCHEMBL9557069

COc1ccc(CCC(=O)N2CC=CCC2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 1/20 0.47
▸ FKBP1A P62942 1/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ MAOA P21397 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HPGD P15428 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL9557154 0.80 FKBP1A (0.64) FKBP1AKMT2AMEN1ALDH1A1MAOA
SCHEMBL9557252 0.78 MAOA (0.54) FKBP1AKMT2AMEN1ALDH1A1MAOA
SCHEMBL9557084 0.78 MAOA (0.56) KMT2AMEN1ALDH1A1MAOAMAOB
SCHEMBL28034769 0.75 POLB (0.54) MAOAPOLBMAPTLMNAHTR1A
SCHEMBL9557185 0.75 MAOA (0.53) FKBP1AKMT2AMEN1ALDH1A1MAOA
SCHEMBL9557091 0.74 MAOA (0.52) FKBP1AKMT2AMEN1ALDH1A1MAOA
SCHEMBL9557043 0.71 NPC1 (0.54) FKBP1AKMT2AMEN1ALDH1A1MAPT
SCHEMBL9556700 0.70 KMT2A (0.48) KMT2AMEN1ALDH1A1MAOAMAPT
SCHEMBL28990846 0.69 POLB (0.62) FKBP1AKMT2AMEN1ALDH1A1POLB
SCHEMBL9557059 0.69 RAB9A (0.51) KMT2AMEN1ALDH1A1MAPTLMNA

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
US-5198450-A PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND USAGE OF THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-03-30 — — US disclosed
EP-0424528-A1 PHENYLALKANOYLAMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 — — EP disclosed
Send feedback