SCHEMBL8916424

SCHEMBL8916424

CN(C)CCCC(=O)c1cc2c(s1)CCCC(=O)N2

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
TSHR P16473 1/20 0.47
CYP2C19 P33261 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
HRH3 Q9Y5N1 1/20 0.36
DAO P14920 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPY5R Q15761 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
RAD52 P43351 1/20 0.31
SLC6A4 P31645 1/20 0.30
ABL1 P00519 1/20 0.30
RIN1 Q13671 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL8918036 0.86 CYP2C19 (0.50) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL8917854 0.75 PARP1 (0.35) HRH3L3MBTL1ALDH1A1NPY5RSIGMAR1
SCHEMBL8920666 0.71 DRD2 (0.57) MEN1TSHRCYP2C19KMT2ASIGMAR1
SCHEMBL8916897 0.68 HTR1A (0.59) KMT2AALDH1A1MAPT
SCHEMBL8915779 0.68 RAB9A (0.93) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL26983413 0.65 KDM4E (0.46) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL19228585 0.65 RAB9A (0.60) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL8917940 0.62 MEN1 (0.53) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL31411868 0.61 HPGD (0.47) MEN1TSHRCYP2C19RAB9AKMT2A
SCHEMBL8915783 0.60 CDC7 (0.36) MEN1CYP2C19KMT2ADAOTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed