SCHEMBL9475490

SCHEMBL9475490

[O-][n+]1[c]c(Cl)cc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.48
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
RAB9A P51151 1/20 0.32
CYP2A6 P11509 1/20 0.31
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
CASP6 P55212 1/20 0.31

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
SCHEMBL9477126 0.76 ATM (0.48) ATMMEN1KMT2ARAB9ACYP2A6
SCHEMBL269155 0.76 ATM (0.48) ATMMEN1KMT2ARAB9ANPC1
SCHEMBL9476641 0.72 ATM (0.44) ATMMEN1KMT2ARAB9ACYP2A6
SCHEMBL9476286 0.71 ATM (0.42) ATMMEN1KMT2ARAB9ANPC1
SCHEMBL1735048 0.67 RAB9A (0.41) ATMMEN1KMT2ARAB9ANPC1
SCHEMBL3084819 0.66 ATM (1.00) ATMMEN1KMT2ARAB9ACYP2A6
SCHEMBL8512795 0.65 ATM (0.50) ATMMEN1KMT2ARAB9ACYP2A6
SCHEMBL28205936 0.64 ATM (0.48) ATMMEN1KMT2ARAB9ACYP2A6
SCHEMBL24772 0.64 ATM (0.43) ATMRAB9ANPC1
SCHEMBL27615068 0.63 ATM (0.57) ATMMEN1KMT2ARAB9ACYP2A6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5270308-A Hypotensives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-12-14 US claimed
US-5270308-A Hypotensives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-12-14 US disclosed
EP-0477789-A1 1,3-Benzoxazine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1992-04-01 EP disclosed