SCHEMBL5760255

SCHEMBL5760255

Cc1ccc2c(c1)CCCN2c1ccnc(Nc2ccc(N3CCOCC3)nc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMG1 Q96Q15 3/20 0.44
▸ CDK1 P06493 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ JAK2 O60674 3/20 0.44
▸ JAK3 P52333 2/20 0.44
▸ FGFR1 P11362 2/20 0.44
▸ KDR P35968 2/20 0.44
▸ CSF1R P07333 2/20 0.44
▸ PDGFRB P09619 2/20 0.44
▸ FLT3 P36888 2/20 0.44
▸ ZAP70 P43403 1/20 0.44
▸ AURKA O14965 1/20 0.44
▸ DAPK3 O43293 1/20 0.44
▸ PRKD3 O94806 1/20 0.44
▸ MAP4K4 O95819 1/20 0.44
▸ PAK4 O96013 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ NTRK1 P04629 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ FYN P06241 1/20 0.44

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
SCHEMBL5760262 0.84 CYP1A2 (0.45) SMG1CDK1CDK2JAK2JAK3
SCHEMBL5759796 0.83 ROCK1 (0.52) CDK1CDK2JAK2JAK3FGFR1
SCHEMBL5759931 0.81 ROCK1 (0.49) CDK2JAK2JAK3FGFR1KDR
SCHEMBL5759792 0.81 KDR (0.49) CDK2JAK2JAK3FGFR1KDR
SCHEMBL5760381 0.81 KDR (0.51) CDK1CDK2JAK2JAK3FGFR1
SCHEMBL5760681 0.79 KDR (0.48) CDK2JAK2JAK3FGFR1KDR
SCHEMBL5758463 0.79 KDR (0.55) JAK2JAK3FGFR1KDRCSF1R
SCHEMBL5759581 0.79 ROCK1 (0.55) ZAP70AURKAMAPK8PTK2ROCK1
SCHEMBL5757460 0.79 ROCK1 (0.47) CDK2JAK2JAK3FGFR1KDR
SCHEMBL27585124 0.78 ROCK1 (0.47) CDK2JAK2JAK3FGFR1KDR

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-7101869-B2 2,4-diaminopyrimidine compounds useful as immunosuppressants PFIZER INC. (US) 2006-09-05 — — US claimed
EP-1242403-B1 2,4-DIAMINOPYRIMIDINE COMPOUNDS USFUL AS IMMUNOSUPPRESSANTS PFIZER PROD INC (US) 2006-01-04 — — EP claimed
US-20030191307-A1 2,4-Diaminopyrimidine compounds useful as immunosuppressants BLUMENKOPF TODD A (US) 2003-10-09 — — US claimed
US-7101869-B2 2,4-diaminopyrimidine compounds useful as immunosuppressants PFIZER INC. (US) 2006-09-05 — — US disclosed
EP-1242403-B1 2,4-DIAMINOPYRIMIDINE COMPOUNDS USFUL AS IMMUNOSUPPRESSANTS PFIZER PROD INC (US) 2006-01-04 — — EP disclosed
US-20030191307-A1 2,4-Diaminopyrimidine compounds useful as immunosuppressants BLUMENKOPF TODD A (US) 2003-10-09 — — US disclosed
EP-1242403-A1 2,4-DIAMINOPYRIMIDINE COMPOUNDS USFUL AS IMMUNOSUPPRESSANTS Pfizer Products Inc. (US) 2002-09-25 — — EP disclosed
WO-2001040215-A1 2,4-DIAMINOPYRIMIDINE COMPOUNDS USFUL AS IMMUNOSUPPRESSANTS PFIZER PRODUCTS INC. (US) 2001-06-07 — — 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-20030191307-A1 2,4-Diaminopyrimidine compounds useful as immunosuppressants CCR1, AOC1, NOD1 SMG1 842/4885CDK1 619/4885CDK2 723/4885

“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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