SCHEMBL4495481

SCHEMBL4495481

Cc1cc2c(s1)C(=O)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
S100A4 P26447 5/20 0.46
PTPRC P08575 5/20 0.46
MAPT P10636 4/20 0.46
MEN1 O00255 4/20 0.46
LMNA P02545 4/20 0.46
BLM P54132 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPSR1 Q6W5P4 3/20 0.46
POLB P06746 3/20 0.46
RAB9A P51151 3/20 0.46
THRB P10828 2/20 0.46
RECQL P46063 2/20 0.46
PLIN1 O60240 2/20 0.46
MAOA P21397 2/20 0.46
MAPK1 P28482 2/20 0.46
PLIN5 Q00G26 2/20 0.46
ABHD5 Q8WTS1 2/20 0.46
KDM4E B2RXH2 2/20 0.46
APAF1 O14727 2/20 0.46

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
SCHEMBL10028800 0.83 PTGS2 (0.40) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL4490123 0.83 PTGS2 (0.40) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL10028797 0.76 PTGS2 (0.39) KMT2AMAPTMEN1LMNABLM
SCHEMBL18045592 0.76 PTPRC (0.47) KMT2AS100A4PTPRCMAPTMEN1
SCHEMBL12924196 0.76 ALDH1A1 (0.33) MAPTSMN1; SMN2MAPK1KDM4EELANE
SCHEMBL4499402 0.75 ALDH1A1 (0.53) MAPTLMNASMN1; SMN2RAB9AMAPK1
SCHEMBL10100082 0.73 PTGS2 (0.40) KMT2AMAPTMEN1LMNABLM
SCHEMBL13470065 0.73 PTGS2 (0.40) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL14294033 0.73 CES1 (0.52) KMT2APTPRCMEN1NPSR1CES1
SCHEMBL12567041 0.73 PTGS2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635781-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2009-12-22 US disclosed
US-7635781-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2009-12-22 US disclosed
US-7635781-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2009-12-22 US disclosed
US-20080287692-A1 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2008-11-20 US disclosed
US-20080287692-A1 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2008-11-20 US disclosed
US-20080287692-A1 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2008-11-20 US disclosed
EP-1387827-B1 SYNTHESIS OF CYCLOPENTADIENE DERIVATIVES BASELL POLYOLEFINE GMBH (DE) 2008-09-24 EP disclosed
EP-1387827-B1 SYNTHESIS OF CYCLOPENTADIENE DERIVATIVES BASELL POLYOLEFINE GMBH (DE) 2008-09-24 EP disclosed
US-7253292-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2007-08-07 US disclosed
US-7253292-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2007-08-07 US disclosed
US-7253292-B2 Synthesis of cyclopentadiene derivatives BASELL POLYOLEFINE GMBH (DE) 2007-08-07 US disclosed
US-20040236115-A1 Synthesis of cyclopentadiene derivatives EQUISTAR CHEMICALS, LP 2004-11-25 US disclosed
EP-1387827-A2 SYNTHESIS OF CYCLOPENTADIENE DERIVATIVES Basell Polyolefine GmbH (DE) 2004-02-11 EP disclosed
WO-2002092564-A2 SYNTHESIS OF CYCLOPENTADIENE DERIVATIVES BASELL POLYOLEFINE GMBH (DE) 2002-11-21 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-20040236115-A1 Synthesis of cyclopentadiene derivatives CYCS, DHPS, CBR1 KMT2A 3209/4885S100A4 3280/4885PTPRC 2658/4885
US-20080287692-A1 Synthesis of cyclopentadiene derivatives CYCS, CYC1, CBR1 KMT2A 4528/4885S100A4 4190/4885PTPRC 2655/4885

“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.