SCHEMBL8098950

SCHEMBL8098950

Cc1ccc2cc(OCc3c(Cl)ccc(OCCN)c3Cl)ccc2n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 5/20 0.37
PPARG P37231 1/20 0.37
NCF1 P14598 4/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
CASP6 P55212 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
BDKRB2 P30411 2/20 0.35
TEC P42680 1/20 0.35
KLKB1 P03952 1/20 0.35
CYP1A2 P05177 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL8097174 0.83 BDKRB2 (0.40) S1PR4PPARGNCF1KDM4EALDH1A1
SCHEMBL6936592 0.83 KDM4E (0.42) NCF1KDM4ELMNAPOLBCASP6
SCHEMBL8106164 0.81 HPGD (0.44) LMNAALDH1A1KLKB1CYP1A2
SCHEMBL8098948 0.77 BDKRB2 (0.61) KDM4ELMNABDKRB2
SCHEMBL8169656 0.77 BDKRB2 (0.41) S1PR4BDKRB2
SCHEMBL8099739 0.77 BDKRB2 (0.42) PPARGKDM4ELMNAPOLBBDKRB2
SCHEMBL6581385 0.76 TP53 (0.42) S1PR4LMNAALDH1A1CYP1A2MAPT
SCHEMBL6935565 0.76 BDKRB2 (0.46) BDKRB2
SCHEMBL6578833 0.76 NCF1 (0.40) PPARGNCF1KDM4ELMNAPOLB
SCHEMBL6578780 0.76 NCF1 (0.40) NCF1KDM4ELMNAPOLBCASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795547-B1 (Aminoalkyl- and acylaminoalkyl-oxy)benzyloxyquinolines, process for their preparation and use as Bradykinin receptor antagonists HOECHST AG (DE) 2000-05-10 EP claimed
EP-0795547-B1 (Aminoalkyl- and acylaminoalkyl-oxy)benzyloxyquinolines, process for their preparation and use as Bradykinin receptor antagonists HOECHST AG (DE) 2000-05-10 EP disclosed
EP-0795547-A1 (Aminoalkyl- and acylaminoalkyl-oxy)benzyloxyquinolines, process for their preparation and use as Bradykinin receptor antagonists HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-17 EP disclosed