SCHEMBL6998640

SCHEMBL6998640

CCOCCn1c(NC2CCN(Cc3ccccc3)CC2)nc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 5/20 0.66
HRH1 P35367 5/20 0.55
KCNH2 Q12809 7/20 0.54
MEN1 O00255 1/20 0.54
MLNR O43193 1/20 0.54
CACNA1F O60840 1/20 0.54
EED O75530 1/20 0.54
USP2 O75604 1/20 0.54
ABCB11 O95342 1/20 0.54
EGFR P00533 1/20 0.54
LMNA P02545 1/20 0.54
HLA-A P04439 1/20 0.54
ERBB2 P04626 1/20 0.54
TP53 P04637 1/20 0.54
CYP1A2 P05177 1/20 0.54
LCK P06239 1/20 0.54
FYN P06241 1/20 0.54
CHRM2 P08172 1/20 0.54
CHRM4 P08173 1/20 0.54
ABCB1 P08183 1/20 0.54

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
SCHEMBL9538075 0.89 SSTR5 (0.64) SSTR5HRH1KCNH2MEN1MLNR
Oxalic Acid SCHEMBL9534979 0.87 HRH1 (0.60) SSTR5HRH1KCNH2
Oxalic Acid SCHEMBL9534990 0.87 HRH1 (0.60) SSTR5HRH1KCNH2
SCHEMBL10434485 0.83 HRH1 (0.49) HRH1KCNH2CHRM1
SCHEMBL10384043 0.83 SSTR5 (0.48) SSTR5HRH1KCNH2MEN1MLNR
SCHEMBL6996286 0.82 SSTR5 (0.47) SSTR5HRH1KCNH2MEN1MLNR
SCHEMBL6991613 0.82 KCNH2 (0.59) HRH1KCNH2MEN1CHRM1KMT2A
SCHEMBL7985310 0.81 KDM4E (0.56) HRH1KCNH2MEN1LMNAGAA
SCHEMBL9536500 0.80 HRH1 (0.62) SSTR5HRH1KCNH2MEN1MLNR
SCHEMBL13319055 0.80 SSTR5 (0.68) SSTR5HRH1KCNH2MEN1MLNR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920425-B1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2003-02-19 EP disclosed
EP-0888336-B1 NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL-AMINO)P IPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2002-08-07 EP disclosed
US-6211199-B1 HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS AVENTIS PHARMACEUTICALS INC. 2001-04-03 US disclosed
US-5922737-A Substituted N-methyl-N-(4-(4-(1H-Benzimidazol-2-YL-amino) piperidin-1-YL)-2-(arlyl) butyl) benzamides useful for the treatment of allergic diseases HOECHST MARION ROUSSEL, INC. (US) 1999-07-13 US disclosed
EP-0920425-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1999-06-09 EP disclosed
EP-0888336-A1 NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL-AMINO)P IPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1999-01-07 EP disclosed
WO-1997030989-A1 NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-08-28 WO disclosed
WO-1997019074-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-05-29 WO disclosed