SCHEMBL8355755

SCHEMBL8355755

NC(N)=NCCSCc1ccccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.49
CYP1A2 P05177 1/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 2/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HRH1 P35367 1/20 0.40
NPY1R P25929 2/20 0.39
ADRA2A P08913 2/20 0.39
ADRA2B P18089 2/20 0.39
ADRA2C P18825 2/20 0.39
HRH4 Q9H3N8 1/20 0.39
LIN28A Q9H9Z2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PLAU P00749 1/20 0.39

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
SCHEMBL31058796 0.79 ALDH1A1 (0.59) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL11530441 0.78 DAO (0.38) LMNATSHRSMN1; SMN2HRH4DAO
SCHEMBL8355557 0.78 PLAU (0.46) LMNAMAPTPLAUDAO
SCHEMBL30732408 0.77 ALDH1A1 (0.58) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL12055882 0.77 ALDH1A1 (0.58) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL11198686 0.77 LMNA (0.49) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL7296244 0.76 HRH1 (0.57) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL8409739 0.76 ALDH1A1 (0.53) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL19305939 0.76 ALDH1A1 (0.57) LMNAALDH1A1CYP1A2TSHRMAPT
SCHEMBL8351885 0.76 ALDH1A1 (0.45) LMNAALDH1A1HRH4PLAUDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952361-A Compositions DIAS NAHOUM CESAR ROBERTO (US) 1999-09-14 US disclosed
US-5908853-A THERAPY FOR SEXUAL DISORDERS Nahoum, Cesar Roberto Dias (BR) 1999-06-01 US disclosed
US-5773457-A Compositions Nahoum, Cesar Roberto Dias (BR) 1998-06-30 US disclosed