SCHEMBL4159480

SCHEMBL4159480

CCOc1ccc2c(c1)CN(C(C)C)CCn1c-2c([C@H]2CCCC[C@@H]2F)c2ccc(C(=O)O)cc21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.35
MTNR1B P49286 5/20 0.35
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CSNK2A3 Q8NEV1 1/20 0.34
SRD5A2 P31213 2/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
PRKCA P17252 1/20 0.32
MMP12 P39900 1/20 0.32
CPT2 P23786 1/20 0.32
CPT1A P50416 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
SCHEMBL4159482 1.00 MTNR1A (0.35) MTNR1AMTNR1BCSNK2A2CSNK2BCSNK2A1
SCHEMBL4148304 0.94 HRH3 (0.34) SRD5A2PRKCAMMP12CNR1CNR2
SCHEMBL4148306 0.94 HRH3 (0.34) SRD5A2PRKCAMMP12CNR1CNR2
SCHEMBL4148776 0.92 KCNH2 (0.36) MTNR1AMTNR1B
SCHEMBL4148779 0.92 KCNH2 (0.36) MTNR1AMTNR1B
SCHEMBL4143938 0.91 HRH3 (0.41)
SCHEMBL4143934 0.91 HRH3 (0.41)
SCHEMBL4152565 0.90 MTNR1A (0.37) MTNR1AMTNR1BCSNK2A2CSNK2BCSNK2A1
SCHEMBL4152561 0.90 MTNR1A (0.37) MTNR1AMTNR1BCSNK2A2CSNK2BCSNK2A1
SCHEMBL4145964 0.88 CYP11B2 (0.33) PRKCAMMP12

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
US-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-05-28 US claimed

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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, ZC3HAV1 MTNR1A 45/4885MTNR1B 139/4885CSNK2A2 287/4885

“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.