SCHEMBL11274774

SCHEMBL11274774

O=P(c1ccccc1)(c1ccccc1)c1nnc(P(=O)(c2ccccc2)c2ccccc2)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 8/20 0.42
▸ CA2 P00918 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ LMNA P02545 1/20 0.38
▸ CFTR P13569 1/20 0.37
▸ MAPT P10636 6/20 0.36
▸ ALDH1A1 P00352 5/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALOX12 P18054 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ALPG P10696 1/20 0.35

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
SCHEMBL11278647 0.80 NPSR1 (0.42) NPSR1CA2CA4CA5ALMNA
SCHEMBL19444921 0.75 KDM4E (0.37) NPSR1MAPTALDH1A1KDM4EKMT2A
SCHEMBL14020797 0.74 KCNA5 (0.44) NPSR1CA2CA4CA5ALMNA
Triphenylphosphine Oxide SCHEMBL513223 0.74 CA2 (0.58) NPSR1CA2CA4CA5ALMNA
Triphenylphosphine Oxide SCHEMBL3949 0.74 CA2 (0.58) NPSR1CA2CA4CA5ALMNA
SCHEMBL17589451 0.73 NPSR1 (0.55) NPSR1CA2CA4CA5ALMNA
SCHEMBL11283350 0.73 CA2 (0.46) NPSR1CA2CA4CA5ALMNA
SCHEMBL14076801 0.73 CA2 (0.41) NPSR1CA2CA4CA5ALMNA
SCHEMBL11280043 0.73 MAPT (0.43) NPSR1CA2CA4CA5ALMNA
SCHEMBL10318987 0.72 PLAU (0.44) NPSR1LMNACFTRMAPTALDH1A1

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
US-4330461-A FIREPROOFING POLYESTERS AND POLYAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-05-18 — — US disclosed
US-4234729-A FIREPROOFING POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-11-18 — — US disclosed
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