SCHEMBL7189891

SCHEMBL7189891

COc1cc(OC)c(C(=O)Pc2ccc(OC(C)OC)cc2OC(C)OC)c(OC)c1.[LiH]

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
CYP3A4 P08684 2/20 0.44
USP2 O75604 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ABCG2 Q9UNQ0 4/20 0.38
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TP53 P04637 1/20 0.35
NPC1 O15118 1/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP1B1 Q16678 1/20 0.34

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
SCHEMBL7184605 0.91 MAPT (0.40) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7178246 0.89 KMT2A (0.43) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7188443 0.88 KMT2A (0.45) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
Lithium SCHEMBL7186870 0.88 KMT2A (0.45) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7175851 0.86 KMT2A (0.45) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
Lithium SCHEMBL7188449 0.86 KMT2A (0.45) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7188265 0.85 KMT2A (0.51) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7180392 0.84 MAPT (0.38) KMT2ASMN1; SMN2ABCG2NPC1
SCHEMBL7182400 0.84 CYP3A4 (0.43) KMT2ACYP3A4USP2MAPK1SMN1; SMN2
SCHEMBL7182448 0.84 KMT2A (0.41) KMT2ACYP3A4USP2MAPK1SMN1; SMN2

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 KMT2A 1586/4885CYP3A4 1652/4885USP2 4168/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 KMT2A 956/4885CYP3A4 1881/4885USP2 3362/4885

“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.