SCHEMBL7349941

SCHEMBL7349941

O=C(O)N=P(c1ccccc1)(c1ccccc1)c1ccccc1CN1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.43
▸ CHRNA7 P36544 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ APP P05067 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ VEGFA P15692 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.38
▸ HPGD P15428 1/20 0.37

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
SCHEMBL7344165 0.99 MEN1 (0.45) KMT2AMEN1ALDH1A1CHRNA7GAA
SCHEMBL7352882 0.75 POLB (0.36) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL7346734 0.73 MAPT (0.39) ALDH1A1GAATSHR
SCHEMBL7350255 0.71 TSHR (0.39) KMT2AMEN1ALDH1A1GAAHTT
SCHEMBL7344848 0.70 RORC (0.39) KMT2AMEN1ALDH1A1TSHR
SCHEMBL753109 0.69 KMT2A (0.57) KMT2AMEN1ALDH1A1CHRNA7KDM4E
SCHEMBL11361974 0.69 ALDH1A1 (0.65) KMT2AMEN1ALDH1A1CHRNA7HTT
SCHEMBL11194277 0.69 ALDH1A1 (0.73) KMT2AMEN1ALDH1A1CHRNA7HTT
SCHEMBL362355 0.69 CA2 (0.44) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL7433040 0.67 ALDH1A1 (0.67) KMT2AMEN1ALDH1A1CHRNA7HTT

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-4892885-A CARDIOTONICS, DIURETICS AMERICAN CYANAMID COMPANY 1990-01-09 — — US disclosed
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