SCHEMBL10079036

SCHEMBL10079036

CN1CCC(Oc2ccc(F)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.60
HTR2B P41595 2/20 0.60
HRH3 Q9Y5N1 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 1/20 0.51
FPR2 P25090 1/20 0.47
PROKR1 Q8TCW9 1/20 0.47
LIPG Q9Y5X9 2/20 0.46
LIPC P11150 1/20 0.44

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
SCHEMBL10262288 1.00 HTR2C (0.60) HTR2CHTR2BHRH3SMN1; SMN2MAPT
SCHEMBL10261788 1.00 HTR2C (0.60) HTR2CHTR2BHRH3SMN1; SMN2MAPT
SCHEMBL10274500 0.91 HRH3 (0.63) HTR2CHTR2BHRH3SMN1; SMN2MAPT
SCHEMBL10078847 0.87 HTR2C (0.47) HTR2CHTR2BHRH3SMN1; SMN2MAPT
SCHEMBL14578240 0.85 HRH3 (0.56) HTR2CHTR2BHRH3SMN1; SMN2
SCHEMBL24596865 0.84 HRH3 (0.54) HTR2CHTR2BHRH3SMN1; SMN2
SCHEMBL10267759 0.84 HTR2C (0.59) HTR2CHTR2BHRH3SMN1; SMN2FPR2
SCHEMBL189416 0.84 HRH3 (0.54) HTR2CHTR2BHRH3SMN1; SMN2
SCHEMBL24596869 0.84 HRH3 (0.54) HTR2CHTR2BHRH3SMN1; SMN2
SCHEMBL15830259 0.84 HTR2C (0.59) HTR2CHTR2BHRH3SMN1; SMN2FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452465-B1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES GENOSCIENCE PHARMA (FR) 2020-11-04 EP disclosed
US-10577362-B2 Substituted 2, 4-diamino-quinoline derivatives for use in the treatment of proliferative diseases GENOSCIENCE PHARMA (FR) 2020-03-03 US disclosed
EP-3233858-B1 ERK INHIBITORS MERCK SHARP & DOHME (US) 2019-10-30 EP disclosed
US-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-10-15 US disclosed
US-20190144437-A1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES GENOSCIENCE PHARMA (FR) 2019-05-16 US disclosed
US-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US disclosed
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 US 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
US-8148404-B2 Modulators of CB1 receptors 7TM PHARMA A/S (DK) 2012-04-03 US disclosed
US-20110003853-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2011-01-06 US disclosed
US-7754750-B2 a -5 substituted 1-H,3-H-imidazolidine-2,4-dione such as 5-(2-{[4-(4'-fluoro[1,1'-biphenyl]-4-yl)-1-piperazinyl]sulfonyl}ethyl)-2,4-imidazolidinedione; protease inhibitors, especially metalloelastase (MMP12) ASTRAZENECA AB (SE) 2010-07-13 US disclosed
US-20100144701-A1 Modulators of CB1 Receptors 7TM PHARMA A/S (DK) 2010-06-10 US disclosed
US-7625934-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2009-12-01 US disclosed
US-20080306065-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-12-11 US disclosed
US-7427631-B2 especially as inhibitors of MMP12 ASTRAZENECA AB (SE) 2008-09-23 US disclosed
US-20080171882-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-07-17 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 (10 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-20110003853-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 HTR2C 3938/4885HTR2B 2661/4885HRH3 3361/4885
US-20080306065-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 HTR2C 3938/4885HTR2B 2661/4885HRH3 3361/4885
US-20190144437-A1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES NQO2, RECQL, CCNO HTR2C 1783/4885HTR2B 1917/4885HRH3 567/4885
US-20080171882-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP14 HTR2C 3938/4885HTR2B 2661/4885HRH3 3361/4885
US-20100144701-A1 Modulators of CB1 Receptors CNR1, CNR2, GPR6 HTR2C 582/4885HTR2B 487/4885HRH3 127/4885
US-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 HTR2C 3701/4885HTR2B 3567/4885HRH3 1000/4885
US-10577362-B2 Substituted 2, 4-diamino-quinoline derivatives for use in the treatment of proliferative diseases NQO2, RECQL, CCNO HTR2C 1783/4885HTR2B 1917/4885HRH3 567/4885
US-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 HTR2C 3701/4885HTR2B 3567/4885HRH3 1000/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HTR2C 3701/4885HTR2B 3567/4885HRH3 1000/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HTR2C 3701/4885HTR2B 3567/4885HRH3 1000/4885

“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.