SCHEMBL17339936

SCHEMBL17339936

CN1CCC(Oc2ccc(Cl)cn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.57
PROKR1 Q8TCW9 1/20 0.57
MMP1 P03956 1/20 0.50
TDO2 P48775 1/20 0.49
MAPK7 Q13164 1/20 0.43
LIPE Q05469 1/20 0.42
HRH3 Q9Y5N1 5/20 0.42
POLB P06746 1/20 0.41
NAMPT P43490 1/20 0.40
CHEK1 O14757 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
PIK3CA P42336 1/20 0.39

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
SCHEMBL20145059 0.85 L3MBTL1 (0.49) FPR2PROKR1MMP1POLBHTR2C
SCHEMBL20069052 0.85 HRH3 (0.56) FPR2PROKR1MMP1HRH3
SCHEMBL30843204 0.85 FPR2 (0.49) FPR2PROKR1MMP1TDO2LIPE
SCHEMBL21652006 0.84 FPR2 (0.47) FPR2PROKR1MMP1HTR2CHTR2B
SCHEMBL13432215 0.83 TDO2 (0.50) FPR2PROKR1TDO2HRH3NAMPT
SCHEMBL4051291 0.82 FPR2 (0.47) FPR2PROKR1MMP1LIPEHRH3
SCHEMBL941502 0.81 FPR2 (0.64) FPR2PROKR1MMP1TDO2
SCHEMBL20147962 0.81 TDO2 (0.61) TDO2MAPK7LIPEHRH3NAMPT
SCHEMBL2816826 0.81 TDO2 (0.49) FPR2PROKR1TDO2HRH3NAMPT
SCHEMBL3617804 0.81 TDO2 (0.49) FPR2PROKR1TDO2HRH3NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2020-12-10 US disclosed
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2020-01-30 US disclosed
WO-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed
US-9212147-B2 Dihydroxy aromatic heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-12-15 US disclosed
US-9212147-B2 Dihydroxy aromatic heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-12-15 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 (2 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-20200383966-A9 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 FPR2 3689/4885PROKR1 438/4885MMP1 3562/4885
US-20200030311-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 FPR2 3689/4885PROKR1 438/4885MMP1 3562/4885

“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.