SCHEMBL13808999

SCHEMBL13808999

CCC(=O)N1CCN(CC)CC1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ TSHR P16473 3/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CCR1 P32246 1/20 0.37
▸ SIGMAR1 Q99720 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ PIK3CD O00329 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ DRD2 P14416 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ CHRNB3 Q05901 1/20 0.35
▸ CHRNA6 Q15825 1/20 0.35
▸ HSD11B1 P28845 4/20 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
SCHEMBL17831928 0.83 SIGMAR1 (0.38) MAPTTHRBSMN1; SMN2TSHRMEN1
SCHEMBL21064697 0.83 SIGMAR1 (0.38) MAPTTHRBSMN1; SMN2TSHRMEN1
SCHEMBL18346708 0.83 SIGMAR1 (0.38) MAPTTHRBSMN1; SMN2TSHRMEN1
SCHEMBL20012727 0.82 THRB (0.42) MAPTTHRBSMN1; SMN2TSHRCCR1
SCHEMBL26112625 0.81 SIGMAR1 (0.37) MAPTTHRBSMN1; SMN2TSHRCCR1
SCHEMBL26112622 0.81 SIGMAR1 (0.37) MAPTTHRBSMN1; SMN2TSHRCCR1
SCHEMBL217915 0.80 — —
SCHEMBL25481489 0.79 MAPT (0.44) MAPTSMN1; SMN2TSHRMEN1HTT
SCHEMBL18346745 0.79 MAPT (0.44) MAPTSMN1; SMN2TSHRMEN1HTT
SCHEMBL10939752 0.79 CHRNB2 (0.44) MAPTSMN1; SMN2TSHRMEN1HTT

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-7553976-B2 Derivatives of 2-(iminomethyl)amino-phenyl, their preparation, their use as medicaments and the pharmaceutical compositions containing them SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS (S.C.R.A.S.) (FR) 2009-06-30 — — US disclosed
US-7459558-B2 Derivatives of 2-(iminomethyl)amino-phenyl, their preparation, their use as medicaments and the pharmaceutical compositions containing them SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2008-12-02 — — US disclosed
US-20080182993-A1 Derivatives of 2-(iminomethyl)amino-phenyl, their preparation, their use as medicaments and the pharmaceutical compositions containing them SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS (S.C.R.A.S.) 2008-07-31 — — 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-20080182993-A1 Derivatives of 2-(iminomethyl)amino-phenyl, their preparation, their use as medicaments and the pharmaceutical compositions containing them ADRB2, ADRA2C, PNMT MAPT 909/4885THRB 2695/4885SMN1; SMN2 2546/4885

“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.

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