SCHEMBL29957635

SCHEMBL29957635

OB(O)c1ccnc2cc(Cl)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.56
SOS2 Q07890 1/20 0.56
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
PKM P14618 1/20 0.51
ALOX15 P16050 1/20 0.51
CASP1 P29466 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CHKA P35790 2/20 0.50
CYP1A2 P05177 1/20 0.50
CLK1 P49759 1/20 0.49
TLR8 Q9NR97 1/20 0.49
MAPT P10636 3/20 0.48
ALDH1A1 P00352 1/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
GAA P10253 1/20 0.48
ATM Q13315 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
SCHEMBL29778053 0.87 NR4A2 (0.58) NR4A2SOS2LMNASMN1; SMN2PKM
SCHEMBL29951591 0.80 TLR8 (0.49) LMNASMN1; SMN2ALOX15CASP1HSD17B10
SCHEMBL783960 0.79 LMNA (0.44) NR4A2SOS2LMNASMN1; SMN2PKM
SCHEMBL28856475 0.79 ALK (0.46) SMN1; SMN2CYP1A2ALDH1A1NCF1KDM4E
SCHEMBL29778037 0.79 FERMT2 (0.45) MAPK1KMT2AMEN1
SCHEMBL29952206 0.76 HTR1A (0.55) LMNACYP1A2TLR8MAPK1GAA
SCHEMBL409748 0.76 NR4A2 (0.61) NR4A2SOS2PKMALOX15CASP1
SCHEMBL30772330 0.76 NR4A2 (0.61) NR4A2SOS2PKMALOX15CASP1
SCHEMBL2710661 0.76 NR4A2 (0.61) NR4A2SOS2LMNASMN1; SMN2PKM
SCHEMBL29491409 0.76 NR4A2 (0.61) NR4A2SOS2LMNASMN1; SMN2PKM

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed