SCHEMBL28112097

SCHEMBL28112097

O=C(OB(O)Oc1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
F2 P00734 1/20 0.48
TSHR P16473 5/20 0.45
TDP1 Q9NUW8 5/20 0.41
TP53 P04637 1/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 5/20 0.41
PARP10 Q53GL7 1/20 0.41
MEN1 O00255 1/20 0.41
NSD2 O96028 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 0.40
POLB P06746 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AKR1C3 P42330 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL38663324 0.86 LMNA (0.58) LMNAF2TSHRTDP1TP53
SCHEMBL9561745 0.82 ALOX15 (0.39) TSHRTDP1PARP10NSD2HSD17B10
SCHEMBL28326886 0.78 LMNA (0.50) LMNAF2TSHRTDP1TP53
SCHEMBL28120446 0.78 ELANE (0.40) LMNATSHRTDP1MAPTALDH1A1
SCHEMBL27447997 0.78 PARP10 (0.41) LMNATSHRTDP1KMT2AMAPT
SCHEMBL28937233 0.78 TSHR (0.57) LMNAF2TSHRTDP1TP53
SCHEMBL11228311 0.77 LMNA (0.58) LMNAF2TSHRTDP1TP53
SCHEMBL1878004 0.76 CA1 (0.46) LMNATSHRALDH1A1
SCHEMBL28089056 0.76 CA1 (0.33) TSHRSMN1; SMN2AKR1C3RAB9A
SCHEMBL28064761 0.76 MTNR1A (0.44) LMNATSHRTDP1TP53KMT2A

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
CN-106146511-A Pyrazolopyrimidine derivative, preparation method, pharmaceutical composition and purposes 安润医药科技(苏州)有限公司 2016-11-23 CN disclosed