SCHEMBL4800348

SCHEMBL4800348

Cc1cc(N)ccc1Oc1nccnc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
GAA P10253 4/20 0.38
PDE10A Q9Y233 1/20 0.37
KDM4E B2RXH2 6/20 0.37
MAPT P10636 5/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
LMNA P02545 3/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CASP1 P29466 4/20 0.35
POLB P06746 2/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
CASP7 P55210 1/20 0.34
ATM Q13315 1/20 0.34
CYP3A4 P08684 1/20 0.33
KEAP1 Q14145 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
SCHEMBL4800468 0.83 CYP3A4 (0.43) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL4799386 0.83 MAPT (0.50) ALDH1A1GAAKDM4EMAPTMEN1
SCHEMBL4796174 0.80 MAP4K4 (0.47) ALDH1A1PDE10AKDM4EMAPTMEN1
SCHEMBL4800340 0.79 GAA (0.38) GAAMEN1KMT2AL3MBTL1POLB
SCHEMBL4329985 0.79 ALDH1A1 (0.56) ALDH1A1GAAPDE10AKDM4EMAPT
SCHEMBL30473086 0.79 ALDH1A1 (0.56) ALDH1A1GAAPDE10AKDM4EMAPT
SCHEMBL18921106 0.77 MEN1 (0.52) ALDH1A1PDE10AKDM4EMAPTMEN1
SCHEMBL30354890 0.77 ALDH1A1 (0.42) ALDH1A1PDE10AKDM4EMAPTMEN1
SCHEMBL4797567 0.77 ALDH1A1 (0.42) ALDH1A1PDE10AKDM4EMAPTMEN1
SCHEMBL4795191 0.77 MEN1 (0.50) ALDH1A1GAAMAPTMEN1KMT2A

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 ALDH1A1 296/4885GAA 1202/4885PDE10A 1610/4885
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 ALDH1A1 342/4885GAA 1915/4885PDE10A 1763/4885

“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.