SCHEMBL25947466

SCHEMBL25947466

COc1ccc(COc2ccc(Nc3nc(Cl)ncc3Cl)c(C)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ NPY1R P25929 1/20 0.43
▸ NPY2R P49146 1/20 0.43
▸ PIK3CA P42336 1/20 0.42
▸ PRKDC P78527 1/20 0.42
▸ P2RX7 Q99572 7/20 0.41
▸ CCNK O75909 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ MAPK10 P53779 2/20 0.39
▸ MAPK8 P45983 1/20 0.39
▸ ADRA2A P08913 1/20 0.39
▸ ADRA2C P18825 1/20 0.39
▸ ADRA1D P25100 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ ADRA1B P35368 1/20 0.39
▸ PTK2 Q05397 1/20 0.39
▸ MAOB P27338 2/20 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
SCHEMBL25947566 0.90 PRKDC (0.44) MAPTPIK3CAPRKDCP2RX7CCNK
SCHEMBL30875683 0.86 MAPK10 (0.38) MAPK10MAPK8MAOBMAPK9NPC1
SCHEMBL25338974 0.84 ALK (0.46) —
SCHEMBL30183996 0.84 ALK (0.46) —
SCHEMBL25947613 0.77 MAPK3 (0.41) MAPTCCNKCCNA2CDK2CDK9
SCHEMBL25947586 0.77 P2RX7 (0.45) PIK3CAPRKDCP2RX7RAB9AMEN1
SCHEMBL2061300 0.76 GAA (0.60) MAPTNPC1MEN1KMT2AGAA
SCHEMBL10071317 0.75 EGFR (0.51) MAPTCCNKCCNA2CDK2CDK9
SCHEMBL29172292 0.74 ALK (0.47) CDK9
SCHEMBL30875693 0.74 ALK (0.47) CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 — — US 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-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS MAP4K1, MAP3K4, MAP4K2 MAPT 119/4885TSHR 4662/4885NPY1R 4674/4885

“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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