SCHEMBL7189987

SCHEMBL7189987

CCOC(C)Oc1cc(OC(C)OCC)c(PC(=O)c2c(OC)cccc2OC)c(OC(C)OCC)c1.[LiH]

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.33
AURKA O14965 1/20 0.33
PPARA Q07869 1/20 0.32
KMT2A Q03164 1/20 0.32
BRPF1 P55201 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 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
SCHEMBL7175436 0.94 FFAR1 (0.35) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7177739 0.91 CYP3A4 (0.39) SMN1; SMN2KMT2A
SCHEMBL7187923 0.89 CA12 (0.40) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7187388 0.88 SMN1; SMN2 (0.38) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7190017 0.87 FFAR1 (0.35) SMN1; SMN2MAPTPPARA
SCHEMBL7178289 0.87 NLRP3 (0.31) PPARATAS1R3TAS1R1TAS1R2
SCHEMBL7181637 0.84 SMN1; SMN2 (0.40) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7186959 0.84 HDAC1 (0.38) SMN1; SMN2CA12CA1CA2CA7
SCHEMBL7183984 0.84 KCNK3 (0.33) KMT2A
SCHEMBL7187589 0.83 BRPF1 (0.42) SMN1; SMN2CA12CA1CA2CA7

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 2939/4885CA12 1552/4885CA1 2219/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 SMN1; SMN2 3105/4885CA12 1320/4885CA1 2302/4885

“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.