SCHEMBL7182352

SCHEMBL7182352

CCOc1cccc(OCC)c1C(=O)c1ccccc1[P](=O)C(=O)c1c(OC)cccc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.41
MAPT P10636 2/20 0.40
HCRTR1 O43613 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 3/20 0.40
TSHR P16473 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL7732147 0.93 MAPT (0.44) KCNK3KCNK9SMN1; SMN2MAPTHCRTR1
SCHEMBL7189022 0.88 HCRTR1 (0.40) KCNK3KCNK9MAPTHCRTR1RAB9A
SCHEMBL7181232 0.87 HCRTR1 (0.39) KCNK3KCNK9SMN1; SMN2MAPTHCRTR1
SCHEMBL7175289 0.86 PPARA (0.40) MAPTRAB9ANPC1LMNAKDM4E
SCHEMBL7188977 0.85 MAPT (0.41) KCNK3KCNK9SMN1; SMN2MAPTRAB9A
SCHEMBL7182147 0.85 KCNK3 (0.48) KCNK3KCNK9SMN1; SMN2HCRTR1RAB9A
SCHEMBL7175433 0.85 KCNK3 (0.39) KCNK3KCNK9MAPTHCRTR1RAB9A
SCHEMBL7183272 0.84 CA12 (0.41) KCNK3KCNK9RAB9ANPC1TP53
SCHEMBL7177390 0.84 CA12 (0.41) KCNK3KCNK9MAPTRAB9ALMNA
SCHEMBL7181297 0.83 MAPT (0.37) KCNK3KCNK9MAPTHCRTR1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579663-B2 Chemical intermediates such as lithium 2,6-dimethylbenzoyl phenylphosphine for preparation of acylphosphines, acylphosphine oxides or acylphosphine sulfides CIBA SPECIALTY CHEMICALS CORPORATION 2003-06-17 US disclosed
US-20020107413-A1 Organometallic monoacylarylphosphines WOLF JEAN-PIERRE (CH) 2002-08-08 US disclosed
US-6399805-B2 SUCH AS LITHIUM 2,6-DIMETHYLBENZOYLPHENYLPHOSPHINE, USE AS PHOTOINITIATORS IN PHOTOCURABLE COMPOSITIONS SUCH AS FOR PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-04 US disclosed
US-20010031898-A1 Organometallic monoacylarylphosphines CIBA SPECIALTY CHEMICALS CORP. 2001-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020107413-A1 Organometallic monoacylarylphosphines CBR1, NAF1, DHCR24 KCNK3 351/4885KCNK9 352/4885SMN1; SMN2 2939/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 KCNK3 388/4885KCNK9 553/4885SMN1; SMN2 3105/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.