SCHEMBL10841737

SCHEMBL10841737

Cc1cc2nnc(-c3cccc([N+](=O)[O-])c3)n2c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.61
▸ TDP1 Q9NUW8 2/20 0.61
▸ RECQL P46063 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ ATM Q13315 1/20 0.58
▸ POLB P06746 1/20 0.58
▸ MAPT P10636 7/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ CDC7 O00311 1/20 0.45
▸ MAP4K4 O95819 1/20 0.45
▸ PIM1 P11309 1/20 0.45
▸ CDK2 P24941 1/20 0.45
▸ GSK3B P49841 1/20 0.45
▸ HIPK2 Q9H2X6 1/20 0.45
▸ CLK4 Q9HAZ1 1/20 0.45
▸ IRAK4 Q9NWZ3 1/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL10842650 0.92 NPSR1 (0.53) THRBTDP1RECQLNPSR1ATM
SCHEMBL10841715 0.87 THRB (0.45) THRBTDP1RECQLNPSR1ATM
SCHEMBL10842466 0.83 MEN1 (0.47) THRBTDP1RECQLNPSR1MAPT
SCHEMBL10842636 0.81 POLB (0.51) THRBTDP1RECQLNPSR1ATM
SCHEMBL11849955 0.74 L3MBTL1 (0.50) THRBTDP1RECQLNPSR1POLB
SCHEMBL10843797 0.74 ALDH1A1 (0.40) THRBTDP1RECQLNPSR1POLB
SCHEMBL9429899 0.70 ATM (0.56) THRBTDP1RECQLNPSR1ATM
SCHEMBL18394406 0.69 RAB9A (0.62) THRBTDP1RECQLNPSR1ATM
SCHEMBL16435341 0.68 TSHR (0.58) THRBTDP1MAPTALDH1A1KMT2A
SCHEMBL10842673 0.68 MAPT (0.45) THRBTDP1RECQLNPSR1ATM

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
EP-0174833-A2 Triazoloquinoline derivatives MAY & BAKER LIMITED (GB) 1986-03-19 — — EP disclosed
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