SCHEMBL7657497

SCHEMBL7657497

Cc1cc2c(=O)nc[nH]c2cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UHRF1 Q96T88 1/20 0.35
▸ PARP1 P09874 3/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ PDE9A O76083 2/20 0.34
▸ NFATC1 O95644 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ PNP P00491 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PRNP P04156 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL19153238 0.85 MAPT (0.38) UHRF1PARP1PIM1CHEK1RPS6KA3
SCHEMBL7970840 0.78 PNP (0.40) PARP1PIM1CHEK1PDE9ADYRK1A
SCHEMBL28490365 0.78 PARP1 (0.35) PARP1PIM1CHEK1NFATC1DYRK1A
SCHEMBL3319993 0.78 GABRP (0.42) PARP1PIM1CHEK1RPS6KA3PDE9A
SCHEMBL6769400 0.77 PDE9A (0.38) PDE9APNPMAPT
SCHEMBL22962863 0.77 PARP1 (0.41) PARP1PIM1CHEK1RPS6KA3PNP
SCHEMBL6769664 0.75 CHEK1 (0.46) CHEK1PDE9A
SCHEMBL1507612 0.74 PARP1 (0.54) PARP1PIM1CHEK1RPS6KA3MEN1
SCHEMBL6364136 0.74 GABRP (0.49) CHEK1PDE9AMAPTKMT2AALDH1A1
SCHEMBL6769464 0.73 PIM1 (0.33) PIM1PIM3PIM2

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-6413971-B1 ANTIPROLIFERATIVE, -CARCINOGENIC, -TUMOR AND -DIABETIC AGENTS; BINDING TO OR MODULATING THE HUMAN KINASE INSERT-DOMAIN-CONTAINING RECEPTOR (KDR) OR THE MURINE FETAL LIVER KINASE 1 (FLK-1) RECEPTOR; VASCULOGENESIS; ANGIOGENESIS PFIZER INC 2002-07-02 — — US disclosed
US-6395733-B1 ANTICANCER AGENTS; ANTIPROLIFERATIVE AGENTS PFIZER INC 2002-05-28 — — US disclosed
US-20020045630-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES ARNOLD LEE DANIEL (US) 2002-04-18 — — US disclosed
EP-0946554-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES PFIZER INC. (US) 1999-10-06 — — EP disclosed
EP-0831829-A4 HETEROCYCLIC RING-FUSED PYRIMIDINE DERIVATIVES PFIZER (US) 1998-11-25 — — EP disclosed
WO-1998023613-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES PFIZER INC. (US) 1998-06-04 — — WO disclosed
EP-0831829-A1 HETEROCYCLIC RING-FUSED PYRIMIDINE DERIVATIVES PFIZER INC. (US) 1998-04-01 — — EP disclosed
WO-1996040142-A1 HETEROCYCLIC RING-FUSED PYRIMIDINE DERIVATIVES PFIZER INC. (US) 1996-12-19 — — 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-20020045630-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES REV1, DPYD, CCNA1 UHRF1 625/4885PARP1 62/4885PIM1 794/4885

“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.

Send feedback