SCHEMBL19921074

SCHEMBL19921074

CN1CCN(c2ccc(Nc3nc(Nc4ccccc4P(C)(C)=O)c4c(ccn4C)n3)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 4/20 0.67
▸ EGFR P00533 10/20 0.52
▸ ALK Q9UM73 6/20 0.50
▸ INSR P06213 5/20 0.50
▸ IGF1R P08069 5/20 0.50
▸ CCNK O75909 1/20 0.48
▸ CCNA2 P20248 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ CCND3 P30281 1/20 0.48
▸ CDK9 P50750 1/20 0.48
▸ CDK6 Q00534 1/20 0.48
▸ FLT3 P36888 2/20 0.46
▸ BTK Q06187 2/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ AURKA O14965 1/20 0.46
▸ NUAK1 O60285 1/20 0.46
▸ JAK2 O60674 1/20 0.46
▸ STK10 O94804 1/20 0.46
▸ PRKD3 O94806 1/20 0.46
▸ SLC34A2 O95436 1/20 0.46

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
SCHEMBL19921085 0.90 PTK2 (0.56) PTK2EGFRALKINSRIGF1R
SCHEMBL19921120 0.86 ALK (0.70) PTK2EGFRALKINSRIGF1R
SCHEMBL19921135 0.84 CCNK (0.50) PTK2EGFRALKCCNKCCNA2
SCHEMBL19921112 0.84 PTK2 (0.62) PTK2EGFRALKINSRIGF1R
SCHEMBL19921229 0.83 PTK2 (0.76) PTK2EGFRALKINSRIGF1R
SCHEMBL19921089 0.81 AXL (0.53) PTK2EGFRALKINSRIGF1R
SCHEMBL32690385 0.80 EGFR (0.76) PTK2EGFRALKINSRIGF1R
SCHEMBL19929896 0.80 PTK2 (0.42) PTK2EGFRALKINSRIGF1R
SCHEMBL19921149 0.80 ALK (0.76) PTK2EGFRALKINSRIGF1R
SCHEMBL19921072 0.80 PTK2 (0.57) PTK2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3290420-B1 PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF UNIV XIAMEN (CN) 2020-12-09 — — EP claimed
US-20180312508-A1 PYRIMIDOPYRROLE COMPOUNDS, METHOD FOR PREPARING THE SAME, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND USES THEREOF XIAMEN UNIVERSITY (CN) 2018-11-01 — — US claimed
EP-3290420-A1 PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF Xiamen University (CN) 2018-03-07 — — EP claimed

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-20180312508-A1 PYRIMIDOPYRROLE COMPOUNDS, METHOD FOR PREPARING THE SAME, PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME AND USES THEREOF TPMT, DHPS, TYMP PTK2 4325/4885EGFR 3364/4885ALK 1505/4885

“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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