SCHEMBL7175696

SCHEMBL7175696

COC(C)Oc1cc(OC(C)OC)c(PC(=O)c2c(Cl)cccc2Cl)c(OC(C)OC)c1.[LiH]

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.33
CXCL12 P48061 1/20 0.33
ALDH1A1 P00352 2/20 0.33
OGG1 O15527 1/20 0.32
ELANE P08246 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
HPGD P15428 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
LMNA P02545 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA4 P13612 1/20 0.30
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7180839 0.95 CA12 (0.36) SMN1; SMN2CXCL12ELANENPC1RAB9A
SCHEMBL7184833 0.94 ABL1 (0.33) SMN1; SMN2CXCL12LMNAITGB1ITGA4
SCHEMBL7190017 0.88 FFAR1 (0.35) SMN1; SMN2ELANECARM1PRMT6MAPT
SCHEMBL7181812 0.87 TDP1 (0.31) ABCG2MEN1KMT2A
SCHEMBL7187923 0.87 CA12 (0.40) SMN1; SMN2ALDH1A1ABCG2MAPTKMT2A
SCHEMBL7182738 0.87 RORC (0.38) SMN1; SMN2ALDH1A1ELANELMNAITGB1
SCHEMBL7177481 0.86 SMN1; SMN2 (0.33) SMN1; SMN2CXCL12ALDH1A1OGG1ELANE
SCHEMBL7175436 0.85 FFAR1 (0.35) SMN1; SMN2CXCL12ALDH1A1ELANENPC1
SCHEMBL7175820 0.84 BRPF1 (0.39) SMN1; SMN2CXCL12ALDH1A1ELANENPC1
SCHEMBL7180504 0.83 TRPM4 (0.33) ELANEITGB1ITGA4MEN1KMT2A

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 SMN1; SMN2 2939/4885CXCL12 4465/4885ALDH1A1 3416/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 SMN1; SMN2 3105/4885CXCL12 4589/4885ALDH1A1 3984/4885

“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.