SCHEMBL6396405

SCHEMBL6396405

COc1ccc(C(=O)C(C)(P=O)C(=O)c2c(C)cccc2C)c(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
MAPT P10636 5/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
RAB9A P51151 2/20 0.43
ABCG2 Q9UNQ0 3/20 0.43
ALDH1A1 P00352 4/20 0.43
TNFRSF1A P19438 1/20 0.42
GAA P10253 2/20 0.41
XDH P47989 1/20 0.40
HPGD P15428 2/20 0.40
RAD52 P43351 1/20 0.40
PKM P14618 2/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL5993310 0.87 NPC1 (0.48) NPC1MAPTKMT2AMEN1RAB9A
SCHEMBL152305 0.78 TDP1 (0.37) NPC1RAB9AALDH1A1GAAHPGD
SCHEMBL5994596 0.76 CYP3A4 (0.41) MAPTKMT2AMEN1ABCG2HPGD
SCHEMBL6399268 0.74 CYP3A4 (0.40) MAPTKMT2AMEN1ABCG2HPGD
SCHEMBL5997923 0.74 L3MBTL1 (0.36) KMT2AMEN1ALDH1A1GAAHPGD
SCHEMBL855232 0.74 NPC1 (0.60) NPC1MAPTKMT2AMEN1RAB9A
SCHEMBL5994244 0.72 ALDH1A1 (0.46) NPC1MAPTKMT2AMEN1RAB9A
SCHEMBL6396397 0.71 TP53 (0.43) NPC1MAPTKMT2AMEN1RAB9A
SCHEMBL2540822 0.71 NPC1 (0.50) NPC1MAPTKMT2AMEN1RAB9A
SCHEMBL5994813 0.71 ALDH1A1 (0.36) KMT2AMEN1ALDH1A1GAAPKM

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 NPC1 850/4885MAPT 4713/4885KMT2A 1784/4885

“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.