SCHEMBL21936740

SCHEMBL21936740

Sc1ccc2cncnc2c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.60
TDO2 P48775 2/20 0.42
IMPDH2 P12268 2/20 0.40
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39
BAZ1A Q9NRL2 1/20 0.38
NOTUM Q6P988 1/20 0.35
PRMT3 O60678 1/20 0.35
FGFR4 P22455 1/20 0.33

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
SCHEMBL20308124 0.83 EGFR (0.60) EGFRTDO2PIK3CDPIK3CABAZ1A
SCHEMBL2010019 0.79 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL8641138 0.78 EGFR (0.64) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL1771613 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL277541 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL1403684 0.75 EGFR (1.00) EGFRTDO2IMPDH2
SCHEMBL559901 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL18618545 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL8207570 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA
SCHEMBL277540 0.75 EGFR (0.60) EGFRTDO2IMPDH2PIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067664-A1 Organic Compound, Light-Emitting Device, Display Device, Electronic Device, Light-Emitting Apparatus, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2024-02-29 US disclosed
EP-3633380-A1 METHOD FOR PREDICTING THERAPEUTIC EFFECT OF LSD1 INHIBITOR BASED ON EXPRESSION OF INSM1 Taiho Pharmaceutical Co., Ltd. (JP) 2020-04-08 EP 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-20240067664-A1 Organic Compound, Light-Emitting Device, Display Device, Electronic Device, Light-Emitting Apparatus, and Lighting Device CCND1, CCND2, DRD1 EGFR 1183/4885TDO2 122/4885IMPDH2 4004/4885

“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.