SCHEMBL14082791

SCHEMBL14082791

CN1CCC(NC(=O)c2ccc(-c3ncccc3Cl)cc2F)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 6/20 0.51
▸ PIK3CA P42336 2/20 0.51
▸ MTOR P42345 2/20 0.51
▸ USP30 Q70CQ3 3/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ SSTR4 P31391 1/20 0.47
▸ WNT1 P04628 1/20 0.46
▸ DYRK1A Q13627 1/20 0.46
▸ CDK2 P24941 2/20 0.46
▸ CDK1 P06493 1/20 0.46
▸ BRD4 O60885 2/20 0.45
▸ CCNT1 O60563 1/20 0.45
▸ CCNA2 P20248 1/20 0.45
▸ CDK9 P50750 1/20 0.45

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
SCHEMBL14082780 0.91 HPGD (0.51) NTRK1USP30MEN1KMT2A
SCHEMBL14082775 0.89 RAB9A (0.51) NTRK1USP30MEN1KMT2AALDH1A1
SCHEMBL14082737 0.88 RAB9A (0.53) NTRK1USP30MEN1KMT2AALDH1A1
SCHEMBL14082770 0.86 SLC6A12 (0.59) KMT2A
SCHEMBL14082757 0.85 NTRK1 (0.46) NTRK1USP30
SCHEMBL14082153 0.83 PIM1 (0.52) MEN1KMT2ASSTR4
SCHEMBL14082744 0.78 TAS1R3 (0.55) NTRK1MEN1KMT2A
SCHEMBL14082788 0.78 TRPV1 (0.43) NTRK1USP30
SCHEMBL14082754 0.78 MCHR1 (0.52) NTRK1ALDH1A1
SCHEMBL14082743 0.77 ALDH1A1 (0.60) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 NTRK1 1169/4885PIK3CA 2004/4885MTOR 2216/4885

“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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