SCHEMBL7804158

SCHEMBL7804158

CN1CCC(n2ncc3ccc(-n4cnnc4)cc32)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.50
HTR1A P08908 1/20 0.50
HTR1F P30939 1/20 0.50
SCD O00767 6/20 0.43
ALOX15 P16050 1/20 0.42
PRMT5 O14744 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR1D P28221 3/20 0.35
HTR2A P28223 4/20 0.34
HTR7 P34969 4/20 0.34
KCNH2 Q12809 3/20 0.34
DRD2 P14416 1/20 0.34
PIK3CD O00329 1/20 0.34
GPR119 Q8TDV5 1/20 0.33

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 SCHEMBL8021880 0.99 HTR1B (0.49) HTR1BHTR1AHTR1FSCDALOX15
SCHEMBL7804939 0.90 HTR1B (0.43) HTR1BHTR1AHTR1FSCDALOX15
Hydrochloric Acid SCHEMBL8031585 0.89 HTR1B (0.42) HTR1BHTR1AHTR1FSCDALOX15
SCHEMBL7804909 0.83 MEN1 (0.38) HTR1BHTR1AHTR1FSCDALOX15
Hydrochloric Acid SCHEMBL8033399 0.82 PRMT5 (0.38) HTR1BHTR1AHTR1FSCDALOX15
SCHEMBL7805945 0.80 DRD4 (0.49) HTR1BHTR1DDRD2
SCHEMBL7804097 0.80 KMT2A (0.51) HTR1BHTR1AHTR1FGAASMN1; SMN2
SCHEMBL15830330 0.80 HTR1A (0.55) HTR1BHTR1AHTR1FSCDALOX15
Hydrochloric Acid SCHEMBL8037880 0.79 DRD4 (0.48) HTR1BSMN1; SMN2HTR1DDRD2
SCHEMBL3349663 0.79 HTR1B (0.54) HTR1BHTR1AHTR1FSCDALOX15

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-0902027-B1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR (FR) 2001-07-25 EP disclosed
EP-0902027-A1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-03-17 EP disclosed