SCHEMBL8417436

SCHEMBL8417436

O=Cc1ccccc1OC1CCN(C(=O)NCc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.60
PRSS1 P07477 1/20 0.60
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
ALDH1A1 P00352 1/20 0.53
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
PDE4B Q07343 1/20 0.52
HRH3 Q9Y5N1 1/20 0.51
TPSAB1 Q15661 1/20 0.49
TPSD1 Q9BZJ3 1/20 0.49
TPSG1 Q9NRR2 1/20 0.49
SCD O00767 1/20 0.48
GRIN2B Q13224 1/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL8417473 0.82 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2PDE4B
SCHEMBL6598031 0.82 F2 (0.57) F2PRSS1MEN1KMT2ANPSR1
SCHEMBL1902995 0.81 HRH1 (0.45) MEN1KMT2AALDH1A1SMN1; SMN2SCD
SCHEMBL8419487 0.81 SMN1; SMN2 (0.58) MEN1KMT2ANPSR1SMN1; SMN2PDE4B
SCHEMBL8419333 0.77 GAA (0.57) MEN1KMT2ANPSR1ALDH1A1TSHR
SCHEMBL2636818 0.77 SCD (0.47) MEN1KMT2AALDH1A1SMN1; SMN2SCD
SCHEMBL1901129 0.77 HRH1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2SCD
SCHEMBL24590680 0.77 TEAD3 (0.47) KMT2ASCDHDAC1HDAC2
SCHEMBL24590454 0.77 NAMPT (0.47) MEN1KMT2AALDH1A1SCD
SCHEMBL8327398 0.76 L3MBTL1 (0.49) MEN1KMT2AALDH1A1TSHRPDE4B

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
US-5889025-A Antidiabetic compounds having hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDY'S RESEARCH FOUNDATION (IN) 1999-03-30 US disclosed