SCHEMBL8307210

SCHEMBL8307210

O=C1N(c2ccccc2)CCC1(CCN1CCC(O)(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 2/20 0.41
HTR3A P46098 1/20 0.39
HRH1 P35367 9/20 0.38
CYP2D6 P10635 7/20 0.38
TP53 P04637 2/20 0.38
METAP2 P50579 3/20 0.38
CHRM1 P11229 3/20 0.38
KCNH2 Q12809 3/20 0.38
NR4A2 P43354 1/20 0.38
TACR2 P21452 1/20 0.37
TACR1 P25103 1/20 0.37

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
SCHEMBL1387253 0.91 SSTR5 (0.42) SSTR5HTR3AHRH1CYP2D6TP53
SCHEMBL7947445 0.88 SSTR5 (0.41) SSTR5HTR3AHRH1CYP2D6TP53
SCHEMBL8303798 0.86 SSTR5 (0.41) SSTR5HTR3AHRH1CYP2D6TP53
SCHEMBL1388865 0.82 HRH1 (0.52) HRH1TACR1
SCHEMBL1387145 0.81 HRH1 (0.53) SSTR5HRH1TACR2TACR1
SCHEMBL7947451 0.80 SSTR5 (0.44) SSTR5HTR3AHRH1CYP2D6CHRM1
SCHEMBL7954465 0.80 HRH1 (0.49) SSTR5HRH1TACR1
SCHEMBL7958381 0.79 KMT2A (0.45) SSTR5HTR3AHRH1CYP2D6CHRM1
SCHEMBL7961463 0.78 HRH1 (0.51) SSTR5HTR3AHRH1CYP2D6TP53
SCHEMBL7962558 0.78 HRH1 (0.50) SSTR5HRH1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0777666-B1 SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMA INC (US) 1999-03-03 EP disclosed