SCHEMBL15739645

SCHEMBL15739645

FC(F)(F)c1ccc(NC2CC2)nc1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 15/20 0.61
CCR7 P32248 2/20 0.53
DPP4 P27487 1/20 0.53
NPY5R Q15761 1/20 0.52
HCAR3 P49019 1/20 0.51
HCRTR1 O43613 1/20 0.51
MALT1 Q9UDY8 1/20 0.50

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
SCHEMBL18607634 0.93 CCR6 (0.55) CCR6CCR7DPP4HCAR3HCRTR1
SCHEMBL15739705 0.93 HCRTR1 (0.55) CCR6CCR7DPP4HCAR3HCRTR1
SCHEMBL13100471 0.92 CCR6 (0.55) CCR6CCR7DPP4NPY5RHCRTR1
SCHEMBL3807921 0.92 CCR6 (0.55) CCR6CCR7DPP4NPY5RHCRTR1
SCHEMBL3328240 0.89 MAPK1 (0.63) CCR6CCR7DPP4HCRTR1
SCHEMBL11934701 0.88 CCR6 (0.52) CCR6CCR7DPP4NPY5RHCRTR1
SCHEMBL11934700 0.88 PIM1 (0.54) CCR6CCR7DPP4NPY5RHCAR3
Hydrochloric Acid SCHEMBL381811 0.88 MAPK1 (0.62) CCR6CCR7DPP4HCRTR1
Hydrochloric Acid SCHEMBL30284852 0.88 MAPK1 (0.62) CCR6CCR7DPP4HCRTR1
Hydrochloric Acid SCHEMBL2418145 0.88 MAPK1 (0.62) CCR6CCR7DPP4HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4615839-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE Bristol-Myers Squibb Company (US) 2025-09-17 EP disclosed
CN-120152973-A Protein tyrosine phosphatase inhibitors, compositions, and methods of use 百时美施贵宝公司 2025-06-13 CN disclosed
US-20240180886-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE BRISTOL-MYERS SQUIBB COMPANY (US) 2024-06-06 US disclosed
WO-2024102794-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE BRISTOL-MYERS SQUIBB COMPANY (US) 2024-05-16 WO disclosed
US-9926314-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2018-03-27 US disclosed
US-9556169-B2 Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG (CH) 2017-01-31 US disclosed
US-20160333012-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS AG (CH) 2016-11-17 US disclosed
CN-105164124-A Compounds and compositions for treating parasitic diseases NOVARTIS AG 2015-12-16 CN disclosed
US-20150344471-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS AG (CH) 2015-12-03 US disclosed
EP-2456444-B1 ADENINE DERIVATIVE AS PI3K INHIBITOR INTELLIKINE LLC (US) 2015-03-18 EP disclosed
WO-2014078802-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2014-05-22 WO 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 (3 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-20150344471-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES MAPT, CYP11B1, CYP11B2 CCR6 2918/4885CCR7 1127/4885DPP4 686/4885
US-20240180886-A1 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE PTPN2, PTPN22, PTPN1 CCR6 2387/4885CCR7 1795/4885DPP4 1696/4885
US-20160333012-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES MAPT, CYP11B1, CYP11B2 CCR6 2918/4885CCR7 1127/4885DPP4 686/4885

“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.