SCHEMBL5828575

SCHEMBL5828575

CC(C)(C)[Si](C)(C)Oc1ccc(-c2ccccc2C=C2NC(=O)SC2=O)cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.39
▸ PTPRCAP Q14761 1/20 0.39
▸ HDAC11 Q96DB2 4/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ RARA P10276 2/20 0.32
▸ RARB P10826 2/20 0.32
▸ RARG P13631 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ NR1I2 O75469 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ HSPD1 P10809 1/20 0.32
▸ GOT1 P17174 1/20 0.32
▸ GLRA1 P23415 1/20 0.32
▸ BLM P54132 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
SCHEMBL5828571 0.91 PTPN11 (0.47) PTPN11PTPRCAPSCN9AMEN1LMNA
SCHEMBL5828573 0.91 PTPN11 (0.47) PTPN11PTPRCAPSCN9AMEN1LMNA
SCHEMBL5827849 0.83 HDAC11 (0.38) PTPN11HDAC11HDAC2HDAC1HDAC7
SCHEMBL404472 0.73 HDAC11 (0.49) PTPN11HDAC11HDAC2HDAC1HDAC7
SCHEMBL5828556 0.73 HDAC11 (0.57) PTPN11PTPRCAPHDAC11HDAC2HDAC1
SCHEMBL399513 0.71 HDAC11 (0.47) PTPN11HDAC11HDAC2HDAC1HDAC7
SCHEMBL6618558 0.71 HDAC11 (0.42) HDAC11HDAC2HDAC1HDAC7HDAC8
SCHEMBL8766824 0.71 RARA (0.41) HDAC11HDAC2HDAC1HDAC7HDAC8
SCHEMBL5827658 0.70 PTPN11 (0.51) PTPN11PTPRCAPHDAC11HDAC2HDAC1
SCHEMBL5827659 0.70 PTPN11 (0.51) PTPN11PTPRCAPHDAC11HDAC2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 — — US claimed
US-7153875-B2 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE SAN DIEGO (US) 2006-12-26 — — US disclosed
US-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases INCYTE GENOMICS, INC. 2002-10-03 — — 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-20020143182-A1 Heterocyclic derivatives for the treatment of cancer and other proliferative diseases CCNY, HRAS, AHR PTPN11 1985/4885PTPRCAP 3488/4885HDAC11 48/4885

“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.

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