SCHEMBL4800469

SCHEMBL4800469

Cc1cc(Oc2ccc(N)cc2C)ccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
ALDH1A1 P00352 3/20 0.38
UHRF1 Q96T88 1/20 0.37
KDM4E B2RXH2 4/20 0.36
POLB P06746 2/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
AAK1 Q2M2I8 1/20 0.36
DYRK1A Q13627 1/20 0.36
TGFBR1 P36897 2/20 0.35
PDE10A Q9Y233 1/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
CASP6 P55212 1/20 0.35

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
SCHEMBL4325879 0.87 NOS3 (0.51) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL4795727 0.84 MAPT (0.47) ALDH1A1KDM4ENOS3NOS1NOS2
SCHEMBL4794749 0.84 GRM2 (0.42) SCN5ASCN9AUHRF1KDM4EPOLB
SCHEMBL1643639 0.84 GRM2 (0.42) AAK1
SCHEMBL15044498 0.84 AAK1 (0.38) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL2028930 0.84 SCN9A (0.43) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL4797567 0.81 ALDH1A1 (0.42) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL30354890 0.81 ALDH1A1 (0.42) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL3370657 0.81 ALOX5AP (0.44) SCN5ASCN9AALDH1A1KDM4EPOLB
SCHEMBL4800457 0.81 UHRF1 (0.37) SCN5ASCN9AUHRF1AAK1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332493-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth OSI PHARMACEUTICALS (US) 2008-02-19 US claimed
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 US claimed
US-6890924-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2005-05-10 US claimed
EP-1292591-B1 SUBSTITUTED BICYCLIC DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PROD INC (US) 2005-02-02 EP claimed
US-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER PRODUCTS INC. 2002-11-14 US claimed
US-7332493-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth OSI PHARMACEUTICALS (US) 2008-02-19 US disclosed
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 US disclosed
US-6890924-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC (US) 2005-05-10 US disclosed
EP-1292591-B1 SUBSTITUTED BICYCLIC DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PROD INC (US) 2005-02-02 EP disclosed
US-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER PRODUCTS INC. 2002-11-14 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 (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-20020169165-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 SCN5A 2703/4885SCN9A 4494/4885ALDH1A1 296/4885
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 SCN5A 3893/4885SCN9A 4709/4885ALDH1A1 342/4885

“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.