SCHEMBL4798142

SCHEMBL4798142

COc1cc(N)ccc1Oc1cnccn1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
SMN1; SMN2 Q16637 1/20 0.63
PLAU P00749 1/20 0.49
KDM4E B2RXH2 3/20 0.47
GAA P10253 2/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
NR4A1 P22736 1/20 0.40
KLK3 P07288 1/20 0.39
PDE4D Q08499 1/20 0.39
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NTRK1 P04629 1/20 0.38
KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL4796604 0.83 KMT2A (0.49) MAPTSMN1; SMN2PLAUKDM4EMEN1
SCHEMBL5318975 0.83 MAPT (0.66) MAPTSMN1; SMN2PLAUKDM4EGAA
SCHEMBL4798133 0.82 MAPT (0.64) MAPTSMN1; SMN2PLAUKDM4EMEN1
SCHEMBL4795125 0.80 GRM4 (0.50) MAPTSMN1; SMN2PLAUKDM4EMEN1
SCHEMBL4796659 0.80 KDM4E (0.49) MAPTSMN1; SMN2KDM4EGAAMEN1
SCHEMBL4797954 0.79 KDM4E (0.47) MAPTSMN1; SMN2KDM4EGAAMEN1
SCHEMBL28286591 0.78 MAPT (0.60) MAPTSMN1; SMN2PLAUKDM4EMEN1
SCHEMBL28502195 0.78 MAPT (0.43) MAPTSMN1; SMN2PLAUKDM4EGAA
SCHEMBL4798226 0.78 MAPT (0.43) MAPTSMN1; SMN2KDM4EGAAIMPDH2
SCHEMBL30354884 0.77 MAPT (0.53) MAPTKDM4EGAAIMPDH2IMPDH1

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-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 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 MAPT 4429/4885SMN1; SMN2 1107/4885PLAU 4128/4885
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 MAPT 4353/4885SMN1; SMN2 915/4885PLAU 4128/4885

“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.