SCHEMBL11352115

SCHEMBL11352115

O=C(O)C(O)Sc1nc2ccccc2s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.55
APEX1 P27695 2/20 0.55
RECQL P46063 1/20 0.55
HPGD P15428 5/20 0.55
ALDH1A1 P00352 5/20 0.55
HSD17B10 Q99714 4/20 0.55
CYP1A2 P05177 4/20 0.55
ALOX15 P16050 3/20 0.55
CYP2C19 P33261 3/20 0.55
HIF1A Q16665 3/20 0.55
CYP2C9 P11712 2/20 0.55
MAPK1 P28482 2/20 0.55
TSHR P16473 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ADRA2A P08913 1/20 0.54
FBP1 P09467 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
DRD2 P14416 1/20 0.54
ADRA2B P18089 1/20 0.54
ADRA2C P18825 1/20 0.54

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
SCHEMBL9306312 0.86 POLB (0.56) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL718296 0.83 PPARA (0.67) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL9624674 0.82 ALDH1A1 (0.52) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL7322651 0.82 PPARA (0.72) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL9443129 0.81 POLB (0.59) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL717957 0.80 LMNA (0.63) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL402778 0.80 ALDH1A1 (0.57) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL8972732 0.80 POLB (0.58) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL8971785 0.79 ALDH1A1 (0.59) POLBAPEX1RECQLHPGDALDH1A1
SCHEMBL9443153 0.79 HPGD (0.59) POLBAPEX1RECQLHPGDALDH1A1

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-4275065-A USEFUL FOR SKIN GRAFTS AND ORGAN TRANSPLANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-06-23 US disclosed