SCHEMBL2943345

SCHEMBL2943345

CSCCC1NC2(CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)N(CC(=O)O)C1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
GAA P10253 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
EPHX2 P34913 5/20 0.38
EPHX1 P07099 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2C9 P11712 1/20 0.37
HSD11B1 P28845 2/20 0.37
MGLL Q99685 1/20 0.36
TACR1 P25103 1/20 0.36
GPR183 P32249 2/20 0.35
TEAD1 P28347 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
SCHEMBL2943359 0.92 HPGD (0.41) MEN1HPGDKMT2AALDH1A1
SCHEMBL2936852 0.89 HRH3 (0.44) EPHX2HSD11B1MGLL
SCHEMBL2942484 0.85 SMN1; SMN2 (0.41) MEN1KMT2AALDH1A1HSD11B1MGLL
SCHEMBL1803209 0.83 TSHR (0.38) MEN1HPGDTSHRKMT2ASIGMAR1
SCHEMBL2936054 0.82 SCD (0.39) CYP3A4CYP2C19CYP2C9GPR183
SCHEMBL2942272 0.81 GAA (0.40) GAACYP2C19ALDH1A1CYP2C9
SCHEMBL2943567 0.81 PROKR1 (0.36) MEN1KMT2AALDH1A1MGLL
SCHEMBL2942901 0.80 CHRNA4 (0.39) KMT2AGAAALDH1A1
SCHEMBL2939777 0.80 MAPT (0.43) GAACYP3A4CYP2C19HSD11B1
SCHEMBL1803743 0.79 HIF1A (0.43) MEN1TSHRKMT2ACYP3A4CYP2C19

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-1730147-B1 SUBSTITUTED 1,4,8-TRIAZASPIRO[4,5]DECAN-2-ON COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY GRUENENTHAL GMBH (DE) 2010-02-03 EP claimed
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds SI, SSTR4, SLC10A2 MEN1 1474/4885HPGD 2897/4885TSHR 1666/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.