SCHEMBL2553797

SCHEMBL2553797

O=C1c2c3ccccc3nn2CCN1CC1CCN(CCc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.47
HTR2A P28223 6/20 0.45
HTR4 Q13639 4/20 0.45
HRH3 Q9Y5N1 2/20 0.43
ACHE P22303 1/20 0.42
HTR2C P28335 1/20 0.40
KCNH2 Q12809 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
Hydrochloric Acid SCHEMBL14633841 0.99 CCR3 (0.46) CCR3HTR2AHTR4HRH3ACHE
SCHEMBL2557120 0.95 CCR3 (0.46) CCR3HTR2AHTR4HRH3ACHE
SCHEMBL2555053 0.92 SSTR5 (0.42) HTR2AHTR2C
Hydrochloric Acid SCHEMBL14633467 0.91 KCNH2 (0.42) KCNH2
Hydrochloric Acid SCHEMBL2554746 0.86 KCNH2 (0.41) KCNH2
SCHEMBL2554628 0.86 HTR2A (0.41) CCR3HTR2AHTR4KCNH2
SCHEMBL2556796 0.81 TACR3 (0.46)
SCHEMBL2551227 0.81 SLC6A2 (0.47) CCR3KCNH2
Hydrochloric Acid SCHEMBL14633798 0.80 SLC6A2 (0.46) CCR3
SCHEMBL2554766 0.80 DRD2 (0.45) HTR4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2556074-A1 TRICYCLIC INDAZOLE COMPOUND, METHOD OF PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING IT AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO - A.C.R.A.F. - S.p.A. (IT) 2013-02-13 EP disclosed
WO-2011124430-A1 TRICYCLIC INDAZOLE COMPOUND, METHOD OF PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING IT AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2011-10-13 WO disclosed