SCHEMBL8611732

SCHEMBL8611732

COc1ccccc1P(c1ccccc1)c1ccccc1-c1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ALOX15 P16050 2/20 0.41
ALOX12 P18054 2/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
PGR P06401 1/20 0.40
AR P10275 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPSR1 Q6W5P4 1/20 0.37
CA12 O43570 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
SCHEMBL30992110 0.83 CA1 (0.50) TP53CA1CA2TSHRALDH1A1
SCHEMBL476857 0.83 CA1 (0.50) TP53CA1CA2TSHRALDH1A1
SCHEMBL30422061 0.82 ALDH1A1 (0.46) CA2MAPTALDH1A1HPGDHSD17B10
SCHEMBL2322069 0.82 ALDH1A1 (0.46) CA2MAPTALDH1A1HPGDHSD17B10
SCHEMBL8459532 0.82 CA1 (0.48) TP53CA1CA2TSHRALDH1A1
SCHEMBL14604217 0.81 DRD2 (0.40) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL6395598 0.80 APP (0.44) TP53CA1CA2ALDH1A1HPGD
SCHEMBL56425 0.80 CA1 (0.50) TP53CA1CA2TSHRALDH1A1
SCHEMBL15656939 0.80 CA1 (0.50) TP53CA1CA2TSHRMAPT
Dimethylamine SCHEMBL8610644 0.79 HSD17B10 (0.41) MAPTALDH1A1HPGDHSD17B10KDM4E

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-5789623-A Process for the preparation of hydroxybiarylphosphines and novel compounds of this group of substances HOECHST AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
EP-0748811-A1 Process for the preparation of hydroxybiarylphosphanes and novel compounds from this materials group HOECHST AKTIENGESELLSCHAFT (DE) 1996-12-18 EP disclosed