SCHEMBL8316249

SCHEMBL8316249

CCn1cc(C2CCNCC2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.53
HTR2C P28335 8/20 0.45
ADRB2 P07550 1/20 0.44
CAMK2D Q13557 1/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
SLC6A4 P31645 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NR4A2 P43354 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
SCHEMBL4055511 0.86 HRH2 (0.53) HTR6HTR2CCAMK2DSLC6A4ALDH1A1
SCHEMBL7136158 0.85 HRH2 (0.49) HTR6HTR2C
SCHEMBL6781286 0.84 HTR6 (0.52) HTR6HTR2CADRB2CAMK2DSLC6A4
SCHEMBL4058347 0.83 HRH2 (0.58) HTR6HTR2C
SCHEMBL14280694 0.83 SMO (0.55) HTR6HTR2CKMT2AMEN1SLC6A4
SCHEMBL4056205 0.82 HTR6 (0.48) HTR6HTR2C
SCHEMBL6824723 0.82 HTR6 (0.48) HTR6HTR2CADRB2CAMK2DSLC6A4
SCHEMBL5937271 0.80 HTR6 (0.57) HTR6HTR2CADRB2CAMK2DKMT2A
Hydrochloric Acid SCHEMBL30611185 0.79 SLC6A4 (0.57) HTR6HTR2CADRB2CAMK2DKMT2A
Hydrochloric Acid SCHEMBL5705102 0.79 SLC6A4 (0.57) HTR6HTR2CADRB2CAMK2DKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189741-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA S.A. (ES) 2007-03-13 US disclosed
EP-0536419-B1 TRICYCLIC TRIAZOLE DERIVATIVES, PRODUCTION AND USE THEREOF TORAY INDUSTRIES (JP) 1999-10-13 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
US-5683998-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, ANTIPAF AGENTS TORAY INDUSTRIES, INC. (JP) 1997-11-04 US 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
EP-0536419-A1 TRICYCLIC TRIAZOLE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF TORAY INDUSTRIES, INC. (JP) 1993-04-14 EP disclosed