SCHEMBL9541693

SCHEMBL9541693

Cc1cc(Oc2ccc(Cl)c(C)c2Cl)cc(C(=O)NO)c1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 2/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ MEN1 O00255 7/20 0.38
▸ KMT2A Q03164 7/20 0.38
▸ GAA P10253 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ RORC P51449 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ TTR P02766 1/20 0.34
▸ PPOX P50336 1/20 0.34

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
SCHEMBL9503167 0.85 TDP1 (0.38) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL9503159 0.85 TDP1 (0.38) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL3304697 0.73 TDP1 (0.56) TDP1ALDH1A1LMNAMEN1KMT2A
SCHEMBL9601597 0.73 KMT2A (0.62) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL9546892 0.70 TDP1 (0.55) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL10690832 0.70 ESRRA (0.47) TDP1ALDH1A1LMNAMEN1KMT2A
SCHEMBL10686059 0.70 MEN1 (0.59) TBXA2RTDP1MEN1KMT2AGAA
SCHEMBL9600761 0.69 TDP1 (0.51) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL9602400 0.69 TDP1 (0.51) TBXA2RTDP1ALDH1A1LMNAMEN1
SCHEMBL10685127 0.69 MEN1 (0.47) TDP1ALDH1A1LMNAMEN1KMT2A

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
JP-5043534-A — — None — — JP disclosed
JP-H0543534-A PHENYL ETHER DERIVATIVE AND ITS PRODUCTION MITSUBISHI PETROCHEM CO LTD 1993-02-23 — — JP disclosed
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