SCHEMBL5554539

SCHEMBL5554539

C#CCN1CCCCC1CO

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.35
CFB P00751 1/20 0.35
TERT O14746 2/20 0.35
SPHK1 Q9NYA1 6/20 0.34
SPHK2 Q9NRA0 5/20 0.34
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 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
SCHEMBL22034423 0.94 POLB (0.42) POLBL3MBTL1SPHK1SPHK2
SCHEMBL1414126 0.94 POLB (0.42) POLBL3MBTL1SPHK1SPHK2
SCHEMBL19989685 0.94 POLB (0.42) POLBL3MBTL1SPHK1SPHK2
SCHEMBL3893332 0.81 CFB (0.38) POLBL3MBTL1ALDH1A1CFBTERT
SCHEMBL2264460 0.77 POLB (0.43) POLBL3MBTL1ALDH1A1CFBTERT
SCHEMBL10867079 0.77 SPHK2 (0.45) POLBL3MBTL1ALDH1A1CFBTERT
SCHEMBL3460783 0.77 POLB (0.43) POLBL3MBTL1ALDH1A1CFBTERT
SCHEMBL23415455 0.76 SPHK2 (0.42) POLBL3MBTL1TERTSPHK1SPHK2
SCHEMBL23415456 0.76 SPHK2 (0.42) POLBL3MBTL1TERTSPHK1SPHK2
SCHEMBL14940685 0.74 POLB (0.47) POLBL3MBTL1ALDH1A1SPHK1SPHK2

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
EP-1147093-B1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2007-04-11 EP disclosed
CN-1182123-C Substituted bicyclic derivatives useful as anticancer agents �Ʒ� 2004-12-29 CN disclosed
US-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents PFIZER INC. 2003-10-02 US disclosed
US-6541481-B2 A quinazoline compound PFIZER INC 2003-04-01 US disclosed
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents KATH JOHN CHARLES (US) 2001-10-25 US disclosed
EP-1147093-A1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2001-10-24 EP disclosed
US-6284764-B1 ANTIPROLIFERATIVE AGENT PFIZER INC. 2001-09-04 US disclosed
WO-2000044728-A1 SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 2000-08-03 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-20030186995-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 POLB 2389/4885L3MBTL1 990/4885ALDH1A1 393/4885
US-20010034351-A1 Substituted bicyclic derivatives useful as anticancer agents CCNA1, MCL1, RCC1 POLB 2389/4885L3MBTL1 990/4885ALDH1A1 393/4885

“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.