SCHEMBL6580465

SCHEMBL6580465

Clc1ccc(C(c2ccccn2)N2CCNCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.65
CYP19A1 P11511 1/20 0.65
FNTA P49354 1/20 0.55
FNTB P49356 1/20 0.55
KDM4E B2RXH2 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
OPRD1 P41143 7/20 0.49
OPRM1 P35372 2/20 0.49
OPRK1 P41145 2/20 0.49
OPRL1 P41146 1/20 0.49
SLC6A4 P31645 5/20 0.45
CHRM2 P08172 3/20 0.45
CHRM1 P11229 3/20 0.45
SLC6A2 P23975 3/20 0.45
SLC6A3 Q01959 3/20 0.45
KCNH2 Q12809 3/20 0.45
HRH3 Q9Y5N1 3/20 0.45
CHRM5 P08912 2/20 0.45

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
SCHEMBL8694125 0.88 MEN1 (0.67) NPSR1MEN1KMT2AOPRD1OPRM1
SCHEMBL7101320 0.86 MEN1 (0.51) CYP2D6CYP19A1FNTAFNTBMEN1
SCHEMBL8304948 0.85 MEN1 (0.55) CYP2D6CYP19A1KDM4EMEN1KMT2A
SCHEMBL9253495 0.83 OPRD1 (0.49) CYP2D6CYP19A1NPSR1MEN1KMT2A
Norchlorcyclizine SCHEMBL7139140 0.81 CYP2D6 (0.81) CYP2D6CYP19A1KDM4ENPSR1MEN1
Norchlorcyclizine SCHEMBL6556514 0.81 CYP2D6 (0.86) CYP2D6CYP19A1KDM4EMEN1KMT2A
Norchlorcyclizine SCHEMBL588655 0.81 CYP2D6 (0.86) CYP2D6CYP19A1KDM4EMEN1KMT2A
Norchlorcyclizine SCHEMBL467086 0.81 CYP2D6 (0.86) CYP2D6CYP19A1KDM4EMEN1KMT2A
SCHEMBL1137956 0.80 CYP2D6 (1.00) CYP2D6CYP19A1MEN1KMT2AOPRD1
SCHEMBL14033470 0.80 FNTA (0.43) CYP2D6CYP19A1FNTAFNTBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1318996-B1 SUBSTITUTED IMIDAZOLES AS DUAL HISTAMINE H1 AND H3 AGONISTS OR ANTAGONISTS SCHERING CORP (US) 2004-12-01 EP disclosed
US-6762186-B2 USE TO TREAT ALLERGY, NASAL CONGESTION, INFLAMMATORY AND CENTRAL NERVOUS SYSTEM-RELATED DISEASES SCHERING CORPORATION 2004-07-13 US disclosed
CN-1461304-A Substituted imidazoles as dual histamine H1 and H3 agonists or antagonists SCHERING CORP (US) 2003-12-10 CN disclosed
EP-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 EP disclosed
EP-1318996-A2 SUBSTITUTED IMIDAZOLES AS DUAL HISTAMINE H1 AND H3 AGONISTS OR ANTAGONISTS Schering Corporation (US) 2003-06-18 EP disclosed
US-20020082278-A1 Substituted imidazoles as dual histamine H1 and H3 agonists or antagonists SCHERING CORPORATION 2002-06-27 US disclosed
WO-2002044141-A2 SUBSTITUTED IMIDAZOLES AS DUAL HISTAMINE H1 AND H3 AGONISTS OR ANTAGONISTS SCHERING CORPORATION (US) 2002-06-06 WO disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 EP 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-20020082278-A1 Substituted imidazoles as dual histamine H1 and H3 agonists or antagonists HRH3, HRH4, HRH2 CYP2D6 1821/4885CYP19A1 2969/4885FNTA 4217/4885

“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.