SCHEMBL4347374

SCHEMBL4347374

COc1ccc(-c2cn(C(=O)Nc3cccc(F)c3)c3ncccc23)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
KIT P10721 2/20 0.46
DHODH Q02127 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.44
PDGFRA P16234 1/20 0.42
KDR P35968 1/20 0.42
AAK1 Q2M2I8 1/20 0.42
PRKCQ Q04759 1/20 0.42
IGF1R P08069 1/20 0.41
HCRTR1 O43613 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
FYN P06241 1/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
CYP1A2 P05177 1/20 0.41
HTR2B P41595 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL13666642 0.90 MEN1 (0.46) MAPTKITABCG2PDGFRAHCRTR1
SCHEMBL4337673 0.89 CFTR (0.47) LMNAMAPTKITDHODHAAK1
SCHEMBL13666644 0.89 ALDH1A1 (0.48) LMNAMAPTKITAAK1POLB
SCHEMBL13668933 0.88 KIT (0.43) LMNAMAPTKITAAK1HCRTR1
SCHEMBL13666640 0.86 GRM4 (0.50) LMNAMAPTRAB9AHTR2CHTR2B
SCHEMBL13666646 0.86 PDGFRB (0.48) LMNAMAPTKITABCG2PDGFRA
SCHEMBL13666647 0.86 IDO1 (0.44) LMNAMAPTKITPDGFRAKDR
SCHEMBL13666639 0.86 MAPT (0.45) LMNAMAPTKITAAK1HCRTR1
SCHEMBL13666645 0.85 GRM4 (0.44) LMNAMAPTPDGFRAKDRHCRTR1
SCHEMBL13668636 0.85 TRPM5 (0.40) LMNAMAPTKITAAK1IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605168-B2 Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline PLEXXIKON, INC. (US) 2009-10-20 US disclosed
US-7605168-B2 Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline PLEXXIKON, INC. (US) 2009-10-20 US disclosed
US-7605168-B2 Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline PLEXXIKON, INC. (US) 2009-10-20 US disclosed
EP-1786813-A2 BICYCLIC HETEROARYL PDE4B INHIBITORS PLEXXIKON, INC. (US) 2007-05-23 EP disclosed
US-20060100218-A1 Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline PLEXXIKON, INC. 2006-05-11 US disclosed
WO-2006026754-A9 BICYCLIC HETEROARYL PDE4B INHIBITORS PLEXXIKON INC (US) 2006-04-20 WO disclosed
WO-2006026754-A2 BICYCLIC HETEROARYL PDE4B INHIBITORS PLEXXIKON, INC. (US) 2006-03-09 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 (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-20060100218-A1 Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline PDE4B, PDE4A, PDE4C LMNA 2921/4885MAPT 572/4885KIT 2971/4885

“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.