SCHEMBL6449762

SCHEMBL6449762

CC(C)(C)[Si](C)(C)Oc1ccc(-c2ccc(C=O)cn2)cc1C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 11/20 0.37
PTGDR Q13258 5/20 0.37
SLC6A9 P48067 1/20 0.35
DGAT1 O75907 3/20 0.35
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
AAK1 Q2M2I8 2/20 0.33
CAMKK2 Q96RR4 1/20 0.33
PTGER2 P43116 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL7262913 0.83 ALDH1A1 (0.36) PTGDR2PTGDRPTGER2
SCHEMBL6447879 0.77 NUDT1 (0.42) PTGDR2PTGDRDGAT1ALOX5APFEN1
SCHEMBL5828071 0.77 HDAC11 (0.41)
SCHEMBL4622962 0.77 S1PR1 (0.35)
SCHEMBL6449181 0.77 ALDH1A1 (0.32)
SCHEMBL6449130 0.74 ALOX5AP (0.45) DGAT1ALOX5APFEN1
SCHEMBL6449169 0.72 PTGDR2 (0.51) PTGDR2PTGDRPTGER2
SCHEMBL7257530 0.71 KDM4E (0.44) PTGDR2PTGDRCA12CA1CA2
SCHEMBL7257541 0.71 KDM4E (0.44) PTGDR2PTGDRCA12CA1CA2
SCHEMBL7257260 0.69 DRD2 (0.38) PTGDR2PTGDRPTGER2

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-20050014767-A1 Benzoxazole, benzothiazole, and benzimidazole derivatives for the treatment of cancer and other diseases INCYTE CORPORATION 2005-01-20 US disclosed
WO-2004066952-A2 BENZOXAZOLE, BENZOTHIAZOLE, AND BENZIMIDAZOLE DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER DISEASES INCYTE CORPORATION (US) 2004-08-12 WO 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-20050014767-A1 Benzoxazole, benzothiazole, and benzimidazole derivatives for the treatment of cancer and other diseases AR, CCNT1, BRD1 PTGDR2 941/4885PTGDR 1117/4885SLC6A9 4271/4885

“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.