SCHEMBL6210266

SCHEMBL6210266

Clc1cnc(Nc2ccc3[nH]cc(C4=CCNCC4)c3c2)nc1NCCc1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ HTR2C P28335 2/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HTR6 P50406 2/20 0.39
▸ STK17A Q9UEE5 7/20 0.39
▸ STK17B O94768 5/20 0.39
▸ CDK1 P06493 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HTR1D P28221 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ BRCA1 P38398 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL6209584 0.96 PTK2 (0.41) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6209610 0.92 PTK2 (0.52) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6214366 0.91 PTK2 (0.43) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6214422 0.91 KDM4E (0.40) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6829733 0.91 PTK2 (0.43) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6209410 0.87 IGF1R (0.48) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6832992 0.86 GSK3B (0.38) KDM4EALDH1A1MAPTHSD17B10HTR2C
SCHEMBL6215668 0.86 GSK3B (0.38) KDM4EALDH1A1MAPTHSD17B10HTR2C
SCHEMBL6242870 0.83 PTK2 (0.52) PTK2KDM4EALDH1A1MAPTHSD17B10
SCHEMBL6212755 0.83 PTK2 (0.46) PTK2KDM4EALDH1A1MAPTHSD17B10

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 PTK2 3004/4885KDM4E 2081/4885ALDH1A1 218/4885

“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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