SCHEMBL7266754

SCHEMBL7266754

CCC1CN(C(=O)NC2CC3CCC(C2)N3C)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 2/20 0.50
TMEM97 Q5BJF2 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
HTR3A P46098 1/20 0.50

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 SCHEMBL7437711 0.99 HTR4 (0.49) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL7266681 0.85 NOTUM (0.53) HTR4TMEM97SIGMAR1HTR3A
Hydrochloric Acid SCHEMBL7439063 0.84 NOTUM (0.52) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL10361731 0.83 TMEM97 (0.46) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL9601595 0.82 TMEM97 (0.43) HTR4TMEM97SIGMAR1HTR3A
Hydrochloric Acid SCHEMBL7446598 0.82 TMEM97 (0.45) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL7432965 0.75 HTR4 (0.50) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL7266518 0.74 SMN1; SMN2 (0.67) HTR4TMEM97SIGMAR1HTR3A
SCHEMBL10246760 0.73 NOTUM (0.64)
Hydrochloric Acid SCHEMBL7447009 0.73 SMN1; SMN2 (0.65) HTR4TMEM97SIGMAR1HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0278173-B1 Use of heterocyclic derivatives in the treatment of depressions GLAXO GROUP LTD (GB) 1993-11-03 EP claimed
EP-0247266-B1 INDOLE DERIVATIVES HAVING AN AZABICYCLIC SIDE CHAIN, PROCESS FOR THEIR PREPARATION, INTERMEDIATES, AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1993-03-10 EP claimed
EP-0247266-A1 Indole derivatives having an azabicyclic side chain, process for their preparation, intermediates, and pharmaceutical compositions BEECHAM GROUP PLC (GB) 1987-12-02 EP claimed
EP-0278173-B1 Use of heterocyclic derivatives in the treatment of depressions GLAXO GROUP LTD (GB) 1993-11-03 EP disclosed