SCHEMBL4801670

SCHEMBL4801670

Cc1cc(Oc2ccc([NH])cc2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.43
UHRF1 Q96T88 1/20 0.42
GRM2 Q14416 6/20 0.39
P2RX3 P56373 4/20 0.37
PPARG P37231 1/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TGFBR1 P36897 1/20 0.35
BRAF P15056 1/20 0.35
GCK P35557 1/20 0.35
CCR1 P32246 1/20 0.34
CCR5 P51681 1/20 0.34
CCR8 P51685 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL8049518 0.85 UHRF1 (0.50) DYRK1AUHRF1GRM2P2RX3HTT
SCHEMBL4794753 0.82 DYRK1A (0.41) DYRK1AUHRF1GRM2P2RX3PPARG
SCHEMBL30699130 0.81 MAPT (0.44) DYRK1AUHRF1GRM2P2RX3BRAF
SCHEMBL11959093 0.81 DYRK1A (0.43) DYRK1AUHRF1GRM2P2RX3PPARG
SCHEMBL178024 0.81 ALDH1A1 (0.55) DYRK1AUHRF1LMNASMN1; SMN2
SCHEMBL171332 0.81 MAPT (0.44) DYRK1AUHRF1GRM2P2RX3BRAF
SCHEMBL8830011 0.81 GCK (0.50) DYRK1AUHRF1PPARGKDM4ELMNA
SCHEMBL4800457 0.80 UHRF1 (0.37) DYRK1AUHRF1GRM2TGFBR1
SCHEMBL4798250 0.78 DYRK1A (0.45) DYRK1AUHRF1SMN1; SMN2TGFBR1CCR1
SCHEMBL3114039 0.78 UHRF1 (0.42) DYRK1AUHRF1GRM2P2RX3PPARG

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 DYRK1A 4214/4885UHRF1 2949/4885GRM2 3313/4885
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 DYRK1A 3580/4885UHRF1 2324/4885GRM2 3734/4885

“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.