SCHEMBL7635103

SCHEMBL7635103

Nc1cccc2nc(-c3ccccc3)c3ccccc3c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 0.56
NUDT1 P36639 3/20 0.56
KMT2A Q03164 5/20 0.49
MEN1 O00255 3/20 0.49
ATM Q13315 2/20 0.49
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
GLA P06280 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
PTBP1 P26599 1/20 0.47
RAB9A P51151 1/20 0.47
RCE1 Q9Y256 1/20 0.47
ACHE P22303 2/20 0.46
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL3833626 0.81 ADORA2A (0.50) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL3469832 0.79 L3MBTL1 (0.53) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL27500599 0.77 KDM4E (0.53) ADORA2ANUDT1KMT2AMAPTGAA
SCHEMBL729919 0.77 NUDT1 (0.61) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL30537037 0.77 NUDT1 (0.61) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL8900058 0.76 KMT2A (0.57) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL16863668 0.76 ELANE (0.44) ADORA2ANUDT1LMNADHODHPDE10A
Iodide SCHEMBL31032485 0.75 NUDT1 (0.59) ADORA2ANUDT1KMT2AMEN1ATM
Hydrochloric Acid SCHEMBL6039708 0.75 MEN1 (0.55) ADORA2ANUDT1KMT2AMEN1ATM
SCHEMBL6039088 0.75 KDM4E (0.59) ADORA2ANUDT1KMT2AMEN1ATM

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
EP-1237946-A1 AMINE-CONTAINING GRAFT POLYMERS, A METHOD FOR MAKING SAME, AND THEIR USE EXXON CHEMICAL PATENTS INC. (US) 2002-09-11 EP claimed
WO-2001029095-A1 AMINE-CONTAINING GRAFT POLYMERS, A METHOD FOR MAKING SAME, AND THEIR USE EXXON CHEMICAL PATENTS INC. (US) 2001-04-26 WO claimed