SCHEMBL6213710

SCHEMBL6213710

Brc1cnc(Nc2cccc3[nH]ncc23)nc1NCCc1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 7/20 0.49
▸ IDO1 P14902 1/20 0.46
▸ TDO2 P48775 1/20 0.46
▸ PIK3CA P42336 5/20 0.46
▸ FGFR1 P11362 2/20 0.43
▸ KDR P35968 2/20 0.43
▸ PTK2 Q05397 2/20 0.43
▸ PTK2B Q14289 2/20 0.43
▸ EPHB4 P54760 1/20 0.40
▸ PIK3CD O00329 3/20 0.40
▸ PIK3CB P42338 3/20 0.40
▸ PIK3CG P48736 3/20 0.40
▸ SYK P43405 1/20 0.39
▸ ZAP70 P43403 1/20 0.39
▸ GBA1 P04062 1/20 0.39

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
SCHEMBL6210462 0.90 TDO2 (0.55) IGF1RIDO1TDO2PIK3CAFGFR1
SCHEMBL6213407 0.89 PTK2 (0.45) IGF1RIDO1TDO2PIK3CAPTK2
SCHEMBL6209471 0.86 IGF1R (0.47) IGF1RPIK3CAFGFR1KDRPTK2
SCHEMBL6211059 0.83 GBA1 (0.50) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6211993 0.81 IGF1R (0.48) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6211871 0.81 PTK2 (0.53) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6210226 0.81 PTK2 (0.61) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6210750 0.80 IGF1R (0.49) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6211636 0.79 PTK2 (0.44) IGF1RFGFR1KDRPTK2PTK2B
SCHEMBL6212411 0.77 PTK2 (0.50) IGF1RIDO1TDO2PIK3CAFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578732-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2005-09-28 — — EP claimed
US-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 — — US claimed
WO-2004056786-A2 PYRIMIDINE DERIVATES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2004-07-08 — — WO claimed
EP-1578732-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2005-09-28 — — EP disclosed
US-20040220177-A1 Compound for the treatment of abnormal cell growth PFIZER INC 2004-11-04 — — US disclosed
WO-2004056786-A2 PYRIMIDINE DERIVATES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2004-07-08 — — 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 (1 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-20040220177-A1 Compound for the treatment of abnormal cell growth CCNA1, CCNB1, CCNT1 IGF1R 93/4885IDO1 2885/4885TDO2 4089/4885

“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.

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