SCHEMBL6818101

SCHEMBL6818101

CCP(=O)(C(=O)c1c(C)cc(C(C)(C)C)cc1C)C(=O)c1c(C(F)(F)F)cccc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.38
CTSS P25774 3/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
P2RX1 P51575 1/20 0.34
F2R P25116 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL5994372 0.90 LMNA (0.42) CTSSF2RLMNAHTTSMN1; SMN2
SCHEMBL5995479 0.88 PLK1 (0.37) ACHECTSSHDAC3HDAC4HDAC1
SCHEMBL5995900 0.88 CTSS (0.38) CTSSP2RX1F2RLMNAHPGD
SCHEMBL5995585 0.86 NPSR1 (0.35) ACHECTSSHDAC3HDAC4HDAC1
SCHEMBL5995846 0.86 SMN1; SMN2 (0.37) ACHEHDAC8F2RLMNASMN1; SMN2
SCHEMBL5993532 0.85 HPGD (0.39) HPGDALDH1A1POLB
SCHEMBL5995631 0.83 CTSS (0.37) ACHECTSSHDAC3HDAC4HDAC1
SCHEMBL5994046 0.83 GABRA1 (0.36) ACHELMNAHTTSMN1; SMN2HPGD
SCHEMBL5994250 0.83 NPSR1 (0.33) ACHECTSSHDAC3HDAC4HDAC1
SCHEMBL5995192 0.82 RAB9A (0.40) ACHEF2RLMNAALDH1A1POLB

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-6737549-B2 PHOTOINITIATORS FOR ACRYLATE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION 2004-05-18 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 (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-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 ACHE 4557/4885CTSS 3803/4885HDAC3 247/4885

“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.