SCHEMBL22955211

SCHEMBL22955211

CCOn1cc(C(=O)O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 4/20 0.46
NR4A2 P43354 2/20 0.46
POLB P06746 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.43
CREBBP Q92793 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C1 Q04828 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL784862 0.84 LMNA (0.44) PLK1ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL22955702 0.82 MAPT (0.50) PLK1ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL22955708 0.80 LMNA (0.52) ALDH1A1MAPTL3MBTL1LMNANR4A2
SCHEMBL22955034 0.78 PLK1 (0.44) PLK1ALDH1A1MAPTLMNANR4A2
SCHEMBL8161027 0.76 GPR84 (0.41) L3MBTL1LMNANR4A2POLBCREBBP
SCHEMBL30373303 0.76 NR4A2 (0.69) PLK1ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL2429622 0.76 NR4A2 (0.69) PLK1ALDH1A1MAPTL3MBTL1LMNA
SCHEMBL22955995 0.75 MEN1 (0.40) ALDH1A1MAPTL3MBTL1LMNAPOLB
SCHEMBL22955597 0.73 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1LMNAPOLB
SCHEMBL5065671 0.73 CNR2 (0.68) PLK1ALDH1A1MAPTCREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4006014-B1 PYRIMIDINE COMPOUND ACTING ON EGFR AND ERBB2 CHINA RESOURCES PHARMACEUTICAL HOLDINGS COMPANY LTD (CN) 2023-10-11 EP disclosed
US-11530196-B2 Pyrimidine compound acting on EGFR and ERBB2 CHINA RESOURCES PHARMACEUTICAL HOLDINGS COMPANY LIMITED (CN) 2022-12-20 US disclosed
EP-4006014-A1 PYRIMIDINE COMPOUND ACTING ON EGFR AND ERBB2 Medshine Discovery Inc. (CN) 2022-06-01 EP disclosed
WO-2021018017-A1 PYRIMIDINE COMPOUND ACTING ON EGFR AND ERBB2 南京明德新药研发有限公司 2021-02-04 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-11530196-B2 Pyrimidine compound acting on EGFR and ERBB2 ERBB2, ERBB3, EGFR PLK1 134/4885ALDH1A1 3162/4885MAPT 3454/4885

“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.