SCHEMBL23355333

SCHEMBL23355333

Cc1ncc(-c2csc(Oc3ccc(N)c(F)c3)n2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.38
NPC1 O15118 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LTA4H P09960 3/20 0.35
MAPT P10636 3/20 0.34
KDM4E B2RXH2 1/20 0.33
GCK P35557 3/20 0.33
PTGES O14684 1/20 0.32
ABL1 P00519 1/20 0.31
MPL P40238 1/20 0.31
ALOX5 P09917 1/20 0.31
TSHR P16473 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL23355368 0.90 LTA4H (0.36) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL29834757 0.86 CDC25A (0.39) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL24037694 0.86 CDC25A (0.39) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL24037371 0.84 CDC25A (0.44) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL23355401 0.81 MEN1 (0.41) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL29834678 0.80 CDC25A (0.35) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL30203387 0.77 CYP17A1 (0.42) MEN1KMT2ASMN1; SMN2MAPTABL1
SCHEMBL24926718 0.77 CYP17A1 (0.42) MEN1KMT2ASMN1; SMN2MAPTABL1
SCHEMBL24037516 0.73 PIK3CD (0.42) PIK3CA
SCHEMBL24037369 0.72 ALDH1A1 (0.34) ALDH1A1LTA4HGCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059698-A1 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES ACCUTAR BIOTECHNOLOGY INC. (US) 2024-02-22 US disclosed
WO-2024026056-A2 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES ACCUTAR BIOTECHNOLOGY, INC. (US) 2024-02-01 WO disclosed
WO-2024026056-A2 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES ACCUTAR BIOTECHNOLOGY, INC. (US) 2024-02-01 WO disclosed
US-20230025510-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-01-26 US disclosed
US-20230025510-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-01-26 US disclosed
EP-3822263-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2021-05-19 EP disclosed
CN-112334460-A Biaryl ether type quinazoline derivative 第一三共株式会社 2021-02-05 CN 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 (2 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-20230025510-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVES ERBB2, EGFR, ERBB3 RAB9A 667/4885NPC1 2118/4885ALDH1A1 2836/4885
US-20240059698-A1 HETEROARYL COMPOUNDS AS EGFR INHIBITORS AND THEIR USES EGFR, ERBB2, ERBB3 RAB9A 1297/4885NPC1 1597/4885ALDH1A1 3627/4885

“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.