SCHEMBL4667664

SCHEMBL4667664

[CH2]CC1CCN(CCN2CCCCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.43
ADRA2C P18825 1/20 0.43
HRH3 Q9Y5N1 5/20 0.42
CYP1A2 P05177 2/20 0.39
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
ACHE P22303 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LTA4H P09960 1/20 0.33
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL4667715 0.98 CHRM5 (0.39) CHRM5ADRA2CHRH3CYP1A2LMNA
SCHEMBL4665976 0.93 CHRM5 (0.34) CHRM5ADRA2CHRH3CYP1A2LMNA
SCHEMBL4666467 0.91 HRH3 (0.50) CHRM5ADRA2CHRH3CYP1A2ACHE
SCHEMBL4664557 0.89 HRH3 (0.46) CHRM5ADRA2CHRH3CYP1A2MAPT
SCHEMBL4667679 0.84 HRH3 (0.41) HRH3ACHE
SCHEMBL4664110 0.80 ALDH1A1 (0.43) CYP1A2ALDH1A1POLBSMN1; SMN2
SCHEMBL4666000 0.78 KDM1A (0.35) ALDH1A1
SCHEMBL4378814 0.77 HRH3 (0.51) CHRM5ADRA2CHRH3CYP1A2LMNA
SCHEMBL4378807 0.77 CHRM5 (0.43) CHRM5ADRA2CHRH3CYP1A2LMNA
SCHEMBL771690 0.77 DRD2 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312273-A1 Quinoline Derivatives Having Vegf Inhibiting Activity HENNEQUIN LAURENT FRANCOIS ANDRE 2008-12-18 US disclosed
US-7371765-B2 Quinoline derivatives having VEGF inhibiting activity ASTRAZENECA AB (SE) 2008-05-13 US disclosed
CN-1315822-C Quinoline derivatives having VEGF inhibiting activity STRAZENECA AB (SE) 2007-05-16 CN disclosed
US-20060148819-A1 Chemical compounds HENNEQUIN LAURENT F A 2006-07-06 US disclosed
CN-1252065-C Cinnoline compounds ASTRAZENECA AB (SE) 2006-04-19 CN disclosed
CN-1245402-C indole derivatives, process for their preparation, pharmaceutical compositions containing them and their use ASTRAZENECA AB (SE) 2006-03-15 CN disclosed
US-6887874-B2 Cinnoline compounds ASTRAZENECA AB (SE) 2005-05-03 US disclosed
CN-1468230-A Compound (I) 2004-01-14 CN disclosed
US-20030212055-A1 Cinnoline compounds ASTRAZENECA AB (SE) 2003-11-13 US disclosed
US-20030207878-A1 Chemical compounds ASTRAZENECA AB (SE) 2003-11-06 US disclosed
US-20030199491-A1 Quinoline derivatives having vegf inhibiting activity ASTRAZENECA AB (SE) 2003-10-23 US disclosed
CN-1446214-A Cinnoline compounds ASTRAZENECA AB (SE) 2003-10-01 CN disclosed
CN-1446212-A Quinoline derivatives having VEGF inhibiting activity STRAZENECA AB (SE) 2003-10-01 CN disclosed
EP-1313726-A1 QUINOLINE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY AstraZeneca AB (SE) 2003-05-28 EP disclosed
EP-1311500-A2 INDOLE, AZAINDOLE AND INDAZOLE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY AstraZeneca AB (SE) 2003-05-21 EP disclosed
EP-1309587-A1 CINNOLINE COMPOUNDS AstraZeneca AB (SE) 2003-05-14 EP disclosed
WO-2002016348-A1 ANTIANGIOGENIC BICYCLIC DERIVATIVES ASTRAZENECA AB (SE) 2002-02-28 WO disclosed
WO-2002012227-A2 INDOLE, AZAINDOLE AND INDAZOLE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY ASTRAZENECA AB (SE) 2002-02-14 WO disclosed
WO-2002012226-A1 QUINOLINE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY ASTRAZENECA AB (SE) 2002-02-14 WO disclosed
WO-2002012228-A1 CINNOLINE COMPOUNDS ASTRAZENECA AB (SE) 2002-02-14 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 (5 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-20080312273-A1 Quinoline Derivatives Having Vegf Inhibiting Activity VEGFA, FLT1, FLT4 CHRM5 1292/4885ADRA2C 1602/4885HRH3 27/4885
US-20030199491-A1 Quinoline derivatives having vegf inhibiting activity VEGFA, FLT1, FLT4 CHRM5 1885/4885ADRA2C 1149/4885HRH3 145/4885
US-20060148819-A1 Chemical compounds VEGFA, NOS3, FLT4 CHRM5 220/4885ADRA2C 223/4885HRH3 5/4885
US-20030207878-A1 Chemical compounds CYP3A7, HTR3C, CNR1 CHRM5 89/4885ADRA2C 52/4885HRH3 44/4885
US-20030212055-A1 Cinnoline compounds VEGFA, PGF, CCR7 CHRM5 757/4885ADRA2C 142/4885HRH3 109/4885

“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.