SCHEMBL6399268

SCHEMBL6399268

COc1cc(OC)c(C(=O)C(C)(P=O)C(=O)c2c(C)cc(C(C)(C)C)cc2C)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.40
USP2 O75604 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ABCG2 Q9UNQ0 3/20 0.37
HPGD P15428 3/20 0.36
KMT2A Q03164 2/20 0.35
LPAR1 Q92633 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
MCL1 Q07820 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL5994596 0.90 CYP3A4 (0.41) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL6403714 0.84 POLB (0.38) HPGDKMT2AMEN1TSHR
SCHEMBL5994813 0.83 ALDH1A1 (0.36) CYP3A4SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL5996436 0.79 RXRB (0.37) SMN1; SMN2HPGDKMT2AKDM4EMEN1
SCHEMBL5993310 0.78 NPC1 (0.48) CYP3A4SMN1; SMN2ABCG2HPGDKMT2A
SCHEMBL5996227 0.75 CYP3A4 (0.39) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL6399267 0.74 CYP3A4 (0.37) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL6396405 0.74 NPC1 (0.44) ABCG2HPGDKMT2AMEN1MAPT
SCHEMBL2499311 0.72 KDM4E (0.41) MAPK1SMN1; SMN2HPGDKMT2AKDM4E
SCHEMBL7181484 0.71 CYP3A4 (0.38) CYP3A4USP2MAPK1SMN1; SMN2ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969733-B2 Photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-11-29 US disclosed
US-20030139485-A1 Photoinitiators WOLF JEAN-PIERRE (CH) 2003-07-24 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 (1 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-20030139485-A1 Photoinitiators DHCR24, NR1I3, CBR1 CYP3A4 432/4885USP2 4345/4885MAPK1 1788/4885

“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.