SCHEMBL20971776

SCHEMBL20971776

Cc1nsc(NC(=O)N2CCC(=Cc3c(F)cc(Cl)cc3F)CC2)n1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.35
▸ HPGDS O60760 3/20 0.35
▸ MAPT P10636 2/20 0.34
▸ TACR3 P29371 3/20 0.34
▸ PROKR1 Q8TCW9 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK1 P23458 1/20 0.34
▸ TACR2 P21452 2/20 0.33
▸ BTK Q06187 1/20 0.33
▸ TACR1 P25103 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ GCK P35557 1/20 0.33

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
SCHEMBL20996663 0.96 MAPT (0.36) TRPV1HPGDSMAPTTACR3PROKR1
SCHEMBL20971816 0.91 TRPV1 (0.35) TRPV1HPGDSTACR3JAK2JAK1
SCHEMBL20971734 0.88 HPGDS (0.38) TRPV1HPGDSMAPTJAK2JAK1
SCHEMBL20971791 0.88 JAK2 (0.36) TRPV1HPGDSTACR3JAK2JAK1
SCHEMBL20971858 0.88 CYP3A4 (0.37) TRPV1HPGDSTACR3JAK2JAK1
SCHEMBL20971837 0.87 GCK (0.33) TRPV1HPGDSTACR3JAK2JAK1
SCHEMBL20971812 0.87 PROKR1 (0.46) TRPV1HPGDSPROKR1
SCHEMBL20997142 0.86 HTR5A (0.36) TRPV1HPGDSTACR3JAK2JAK1
SCHEMBL20996769 0.85 JAK2 (0.35) TRPV1HPGDSMAPTTACR3JAK2
SCHEMBL20996923 0.85 TACR3 (0.31) TRPV1TACR3PROKR1TACR2TACR1

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-20190142810-A1 MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS BASILEA PHARM INT AG (CH) 2019-05-16 — — US claimed
US-20190142810-A1 MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS BASILEA PHARM INT AG (CH) 2019-05-16 — — US disclosed
US-20190142810-A1 MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS BASILEA PHARM INT AG (CH) 2019-05-16 — — 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-20190142810-A1 MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS NDUFAB1, FH, MT-ND1 TRPV1 3515/4885HPGDS 2964/4885MAPT 1795/4885

“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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