SCHEMBL5338308

SCHEMBL5338308

CCOC(=O)C1=CCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
MEN1 O00255 2/20 0.42
TSHR P16473 2/20 0.41
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
BRD4 O60885 1/20 0.39
MAPT P10636 5/20 0.38
CYP1A2 P05177 3/20 0.38
KDM4E B2RXH2 3/20 0.38
LMNA P02545 2/20 0.38
ALOX15 P16050 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL5799259 0.89 GSTP1 (0.44) KMT2AMEN1TSHRBRD4MAPT
SCHEMBL819891 0.79 TSHR (0.45) KMT2AMEN1TSHRCA12CA1
SCHEMBL8569125 0.79 PTPN1 (0.41) TSHRCA12CA1CA2CA7
SCHEMBL43932 0.78
SCHEMBL1779388 0.76 ALDH1A1 (0.39) KMT2AMEN1TSHRCA12CA1
SCHEMBL15957919 0.75 PTPN1 (0.52) KMT2AMEN1TSHRMAPTLMNA
SCHEMBL31196992 0.74 TSHR (0.48) KMT2AMEN1TSHRCA12CA1
SCHEMBL13159212 0.74 ALDH1A1 (0.52) KMT2AMEN1TSHRCA12CA1
SCHEMBL6227521 0.73 KMT2A (0.38) KMT2AMEN1TSHRCA12CA1
SCHEMBL818456 0.72 CA12 (0.44) KMT2AMEN1TSHRCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7288650-B2 Cyclic substituted fused pyrrolocarbazoles and isoindolones CEPHALON, INC. (US) 2007-10-30 US disclosed
US-7074793-B2 Cyclic substituted fused pyrrolocarbazoles and isoindolones CEPHALON, INC. (US) 2006-07-11 US disclosed
US-20060128780-A1 Cyclic substituted fused pyrrolocarbazoles and isoindolones CEPHALON, INC. (US) 2006-06-15 US disclosed
US-6841567-B1 Cyclic substituted fused pyrrolocarbazoles and isoindolones CEPHALON, INC. (US) 2005-01-11 US disclosed
US-20040186157-A1 Cyclic substituted fused pyrrolocarbazoles and isoindolones CEPHALON, INC. (US) 2004-09-23 US disclosed
EP-1165562-A1 CYCLIC SUBSTITUTED FUSED PYRROLOCARBAZOLES AND ISOINDOLONES Cephalon, Inc. (US) 2002-01-02 EP disclosed
WO-2000047583-A9 CYCLIC SUBSTITUTED FUSED PYRROLOCARBAZOLES AND ISOINDOLONES CEPHALON INC (US) 2001-09-20 WO disclosed
WO-2000047583-A1 CYCLIC SUBSTITUTED FUSED PYRROLOCARBAZOLES AND ISOINDOLONES CEPHALON, INC. (US) 2000-08-17 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 (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-20040186157-A1 Cyclic substituted fused pyrrolocarbazoles and isoindolones PIN1, PAICS, QPCT KMT2A 3858/4885MEN1 3793/4885TSHR 4078/4885
US-20060128780-A1 Cyclic substituted fused pyrrolocarbazoles and isoindolones PIN1, PAICS, QPCT KMT2A 3858/4885MEN1 3793/4885TSHR 4078/4885

“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.