SCHEMBL6402169

SCHEMBL6402169

Cc1cc(C)c(C(=O)[P](=O)C(C)C(=O)c2c(C)cccc2C)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
GPR52 Q9Y2T5 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
KMT2A Q03164 5/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 2/20 0.31
NFE2L2 Q16236 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
TP53 P04637 1/20 0.30
GAA P10253 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL5997547 1.00 HPGD (0.37) HPGDNPSR1MCOLN3GPR52L3MBTL1
SCHEMBL5995853 0.87 ACHE (0.36) GPR52L3MBTL1SMN1; SMN2ALDH1A1TDP1
SCHEMBL6402780 0.87 MEN1 (0.39) HPGDNPSR1MCOLN3KMT2AMEN1
SCHEMBL5997841 0.87 ACHE (0.36) GPR52L3MBTL1SMN1; SMN2ALDH1A1TDP1
SCHEMBL6398273 0.86 HPGD (0.34) HPGDNPSR1MCOLN3L3MBTL1KMT2A
SCHEMBL5997093 0.85 CA12 (0.41) KMT2AMEN1GAA
SCHEMBL5996726 0.85 TAS1R3 (0.38) KMT2ASMN1; SMN2ALDH1A1TP53
SCHEMBL5994381 0.84 SMN1; SMN2 (0.41) HPGDNPSR1MCOLN3KMT2AMEN1
SCHEMBL6400246 0.84 RXRB (0.33) HPGDNPSR1MCOLN3L3MBTL1
SCHEMBL5995832 0.84 RXRB (0.33) HPGDNPSR1MCOLN3L3MBTL1

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-6969733-B2 Photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-11-29 US disclosed
US-6737549-B2 PHOTOINITIATORS FOR ACRYLATE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION 2004-05-18 US disclosed
US-20030139485-A1 Photoinitiators WOLF JEAN-PIERRE (CH) 2003-07-24 US disclosed
US-20020026049-A1 Photoinitiators for acrylate coatings CIBA SPECIALTY CHEMICALS CORP. 2002-02-28 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-20030139485-A1 Photoinitiators DHCR24, NR1I3, CBR1 HPGD 2368/4885NPSR1 715/4885MCOLN3 149/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 HPGD 3884/4885NPSR1 505/4885MCOLN3 167/4885

“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.