SCHEMBL21801997

SCHEMBL21801997

CN(C)c1cccc(Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.43
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CNR1 P21554 1/20 0.38
HTR3E A5X5Y0 2/20 0.37
HTR3B O95264 2/20 0.37
HTR3A P46098 2/20 0.37
HTR3D Q70Z44 2/20 0.37
HTR3C Q8WXA8 2/20 0.37
PDE10A Q9Y233 2/20 0.37
DYRK1A Q13627 1/20 0.37
ALDH1A1 P00352 3/20 0.36
SMPD3 Q9NY59 2/20 0.36
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
CKS1B P61024 1/20 0.34
SKP1 P63208 1/20 0.34

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
SCHEMBL22617776 0.82 TSHR (0.39) CYP3A4TSHRMEN1KMT2AHTR3E
SCHEMBL4271497 0.82 NCF1 (0.52) NCF1CYP3A4TSHRMEN1KMT2A
SCHEMBL16114069 0.79 CNR1 (0.44) CYP3A4TSHRKMT2ACNR1HTR3E
SCHEMBL20758812 0.76 PDE10A (0.39) NCF1PDE10A
SCHEMBL14627577 0.76 CYP3A4 (0.42) CYP3A4TSHRMEN1KMT2AHTR3E
SCHEMBL2308330 0.73 CCR1 (0.50) NCF1CYP3A4TSHRMEN1KMT2A
SCHEMBL31415250 0.73 CCR1 (0.50) NCF1CYP3A4TSHRMEN1KMT2A
SCHEMBL3924623 0.73 CYP3A4 (0.32) CYP3A4TSHRMEN1KMT2AHTR3E
SCHEMBL58195 0.73
SCHEMBL11621298 0.71 NCF1 (0.43) NCF1CYP3A4TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220119348-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2022-04-21 US disclosed
US-20220119348-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2022-04-21 US disclosed
US-11161815-B2 Hydrocarbylsulfonyl-substituted pyridines and their use in the treatment of cancer OBLIQUE THERAPEUTICS AB (SE) 2021-11-02 US disclosed
US-11161815-B2 Hydrocarbylsulfonyl-substituted pyridines and their use in the treatment of cancer OBLIQUE THERAPEUTICS AB (SE) 2021-11-02 US disclosed
US-11028067-B2 Heteroarylsulfonyl-substituted pyridines and their use in the treatment of cancer OBLIQUE THERAPEUTICS AB (SE) 2021-06-08 US disclosed
US-11028067-B2 Heteroarylsulfonyl-substituted pyridines and their use in the treatment of cancer OBLIQUE THERAPEUTICS AB (SE) 2021-06-08 US disclosed
US-10899710-B2 Pyridines and their use in the treatment of cancer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-01-26 US disclosed
US-20200239417-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2020-07-30 US disclosed
US-20200239417-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2020-07-30 US disclosed
US-20200223819-A1 HETEROARYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2020-07-16 US disclosed
US-20200223819-A1 HETEROARYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2020-07-16 US disclosed
US-20200087260-A1 PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER The USA, as Represented by the Secretary, Department pf Health and Human Services (US) 2020-03-19 US disclosed
CN-105745214-B Tricyclic piperidine compounds 埃科特莱茵药品有限公司 2019-02-19 CN 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 (7 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-20200239417-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, ABL1, IDH1 NCF1 2517/4885CYP3A4 101/4885TSHR 1159/4885
US-20200223819-A1 HETEROARYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER TP53, GLS2, KRAS NCF1 2593/4885CYP3A4 238/4885TSHR 898/4885
US-20220119348-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, ABL1, IDH1 NCF1 2517/4885CYP3A4 101/4885TSHR 1159/4885
US-10899710-B2 Pyridines and their use in the treatment of cancer TP53, NDUFS3, NDUFS2 NCF1 1499/4885CYP3A4 249/4885TSHR 538/4885
US-20200087260-A1 PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER TP53, NDUFS3, NDUFS2 NCF1 1499/4885CYP3A4 249/4885TSHR 538/4885
US-11161815-B2 Hydrocarbylsulfonyl-substituted pyridines and their use in the treatment of cancer HCCS, ABL1, IDH1 NCF1 2517/4885CYP3A4 101/4885TSHR 1159/4885
US-11028067-B2 Heteroarylsulfonyl-substituted pyridines and their use in the treatment of cancer TP53, GLS2, KRAS NCF1 2593/4885CYP3A4 238/4885TSHR 898/4885

“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.