SCHEMBL7185372

SCHEMBL7185372

CCCOc1cc(OCCC)c(PC(=O)c2c(OC)cc(OC)cc2OC)c(OCCC)c1.[LiH]

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
MAPK1 P28482 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.36
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
ERN1 O75460 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
SCHEMBL7181351 0.94 HDAC3 (0.41) CYP3A4SMN1; SMN2USP2MAPK1MTNR1A
SCHEMBL7188509 0.92 PLA2G2A (0.42) CYP3A4KDM4E
SCHEMBL7175182 0.91 PLA2G2A (0.44) CYP3A4KDM4E
SCHEMBL7188800 0.90 CA12 (0.42) SMN1; SMN2MTNR1AMTNR1BKDM4EKMT2A
SCHEMBL7182404 0.90 CYP3A4 (0.39) CYP3A4SMN1; SMN2USP2MAPK1KDM4E
SCHEMBL7177745 0.89 APP (0.37) CYP3A4SMN1; SMN2USP2MAPK1KDM4E
SCHEMBL7183040 0.86 MAPK1 (0.41) CYP3A4SMN1; SMN2USP2MAPK1KDM4E
SCHEMBL7183640 0.86 MAPK1 (0.38) CYP3A4SMN1; SMN2USP2MAPK1KDM4E
SCHEMBL7181350 0.84 KMT2A (0.42) CYP3A4SMN1; SMN2USP2MAPK1MTNR1A
SCHEMBL7181299 0.84 PPARA (0.41) SMN1; SMN2HPGD

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 CYP3A4 1652/4885SMN1; SMN2 2939/4885USP2 4168/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 CYP3A4 1881/4885SMN1; SMN2 3105/4885USP2 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.