SCHEMBL8002371

SCHEMBL8002371

O=C1NCC=NN1c1cc(Cl)c(Cc2ccc(C(O)c3cccnc3)cc2)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CYP17A1 P05093 1/20 0.37
CYP11B1 P15538 1/20 0.36
PHGDH O43175 2/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.33
PDE10A Q9Y233 1/20 0.33
TSHR P16473 1/20 0.32
CYP51A1 Q16850 2/20 0.32
F2 P00734 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
MAPT P10636 1/20 0.31
TP53 P04637 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31

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
SCHEMBL8005167 0.89 PRMT5 (0.31) PRMT5WDR77
SCHEMBL8002347 0.87 PRMT5 (0.30) PRMT5WDR77
SCHEMBL8000562 0.82
SCHEMBL7989885 0.81 S1PR1 (0.33)
SCHEMBL8002706 0.76 LSS (0.34) SMN1; SMN2CYP17A1LMNAMAPT
SCHEMBL7839566 0.76 KMT2A (0.39) LMNATSHRMAPTTP53
SCHEMBL7470125 0.75 VNN1 (0.34)
SCHEMBL8002443 0.74 MAPT (0.34) SMN1; SMN2MAPT
SCHEMBL7989850 0.73 ALDH1A1 (0.32)
SCHEMBL8000417 0.73 MEN1 (0.34) SMN1; SMN2L3MBTL1MAPT

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-6294536-B1 CONTROL OF PROTOZOA AND REDUCTION IN THE INCIDENCE OF ASSOCIATED DISEASES AND DEATH AND CONSEQUENT IMPROVEMENT IN RETARDED GROWTH AND GENERAL CONDITION AND PREVENTING DECREASE GROWTH AND GENERAL CONDITION TAKEDA SCHERING-PLOUGH ANIMAL HEALTH K.K. (JP) 2001-09-25 US disclosed