SCHEMBL9099571

SCHEMBL9099571

O=P(c1ccccc1)(c1ccccc1)c1cccc(Cl)c1I

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 4/20 0.36
PTK2B Q14289 1/20 0.36
KDM4E B2RXH2 3/20 0.35
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
APOBEC3A P31941 1/20 0.34
CASP6 P55212 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
LMNA P02545 3/20 0.33
TSHR P16473 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL28344959 0.82 NPSR1 (0.44) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL30626935 0.81 NPSR1 (0.45) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL10635222 0.78 CA2 (0.41) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL8912817 0.78 NPSR1 (0.42) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL10524389 0.76 NPSR1 (0.40) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL4762963 0.75 POLB (0.52) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL27164648 0.74 CA2 (0.41) NPSR1KMT2AALDH1A1HTTMAPT
SCHEMBL7638842 0.74 POLB (0.44) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL8994708 0.74 KMT2A (0.49) NPSR1KMT2AMEN1POLBALDH1A1
SCHEMBL8164398 0.74 NPSR1 (0.50) NPSR1KMT2AMEN1POLBALDH1A1

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-5510503-A Bisphosphines for asymmetric hydrogenation catalysts BAYER AKTIENGESELLSCHAFT (DE) 1996-04-23 US disclosed