SCHEMBL14112985

SCHEMBL14112985

COc1ccc2nc(S)n(C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.46
PDE3A Q14432 2/20 0.46
PDE2A O00408 1/20 0.46
ALDH1A1 P00352 4/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
MAPK10 P53779 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
USP2 O75604 1/20 0.45
MAPT P10636 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL1104364 0.86 ALDH1A1 (0.55) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL9148447 0.81 ALDH1A1 (0.43) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL13035828 0.81 ALDH1A1 (0.56) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL5456431 0.79 CYP1A2 (0.50) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL4650051 0.77 MTNR1A (0.56) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL29468491 0.77 TLR8 (0.43) PDE3BPDE3APDE2AALDH1A1MAPK1
SCHEMBL12119549 0.76 ALDH1A1 (0.54) ALDH1A1HPGDMAPK1HTTMAPK10
SCHEMBL14160770 0.76 ACSS2 (0.38) PDE3BPDE3APDE2AMAPTACSS2
SCHEMBL9868395 0.76 ALDH1A1 (0.50) PDE3BPDE3APDE2AALDH1A1HPGD
SCHEMBL10187684 0.76 ACSS2 (0.52) PDE3BPDE3APDE2AALDH1A1HPGD

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
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 US disclosed
US-20080160452-A1 Developer for light sensitive planographic printing plate material and manufacturing process of planographic printing plate employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-07-03 US disclosed