SCHEMBL22955702

SCHEMBL22955702

COn1cc(C(=O)O)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
NR4A2 P43354 3/20 0.49
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 5/20 0.47
KDM4E B2RXH2 2/20 0.47
THRB P10828 1/20 0.47
MEN1 O00255 4/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C1 Q04828 1/20 0.46
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
PLK1 P53350 1/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL7519027 0.89 LMNA (0.58) ALDH1A1KDM4ELMNA
SCHEMBL19691124 0.85 NR4A2 (0.47) MAPTNR4A2ALDH1A1KMT2AKDM4E
SCHEMBL3050804 0.85 NR4A2 (0.47) MAPTNR4A2ALDH1A1KMT2AKDM4E
SCHEMBL1849453 0.85 NR4A2 (0.69) MAPTNR4A2ALDH1A1KMT2AKDM4E
SCHEMBL22955211 0.82 PLK1 (0.47) MAPTNR4A2ALDH1A1KMT2AMEN1
SCHEMBL22955034 0.82 PLK1 (0.44) MAPTNR4A2ALDH1A1KMT2AMEN1
SCHEMBL18938520 0.80 KMT2A (0.44) MAPTNR4A2ALDH1A1KMT2AKDM4E
SCHEMBL784862 0.79 LMNA (0.44) MAPTALDH1A1KMT2AKDM4EMEN1
SCHEMBL29965768 0.77 POLB (0.72) MAPTNR4A2ALDH1A1KMT2AKDM4E
SCHEMBL535878 0.77 POLB (0.72) MAPTNR4A2ALDH1A1KMT2AKDM4E

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 MAPT 3454/4885NR4A2 665/4885ALDH1A1 3162/4885

“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.