SCHEMBL24037306

SCHEMBL24037306

CC(C)(C)c1coc2cncc-2c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
PTK2 Q05397 1/20 0.31

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
SCHEMBL11916005 0.74 KIF11 (0.56) KIF11LMNAKDM4EMAPT
SCHEMBL12459123 0.72 CHRNB1 (0.41) KIF11LMNAPKMKDM4EMAPT
SCHEMBL26781787 0.71 KIF11 (0.43) KIF11
SCHEMBL26244710 0.69 CYP11B1 (0.33) LMNAPKMPTK2
SCHEMBL23959634 0.69 KDM4E (0.45) KIF11S1PR1S1PR3KDM4EGAA
SCHEMBL23959637 0.69 KDM4E (0.45) KIF11S1PR1S1PR3KDM4EGAA
SCHEMBL23959653 0.69 KDM4E (0.45) KIF11S1PR1S1PR3KDM4EGAA
SCHEMBL24250988 0.68 RAB9A (0.48) KIF11LMNAS1PR1S1PR3KDM4E
SCHEMBL19728970 0.68 CYP1A2 (0.38) S1PR1S1PR3KDM4EMAPT
SCHEMBL12245394 0.68 MEN1 (0.58) KIF11LMNAPKMGAAPTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814379-B2 Cyano quinoline amide compounds as HER2 inhibitors and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-11-14 US disclosed
US-11814379-B2 Cyano quinoline amide compounds as HER2 inhibitors and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-11-14 US disclosed
US-20210355119-A1 CYANO QUINOLINE AMIDE COMPOUNDS AS HER2 INHIBITORS AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. 2021-11-18 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 (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-11814379-B2 Cyano quinoline amide compounds as HER2 inhibitors and methods of use ERBB2, EGFR, ERBB3 KIF11 3905/4885LMNA 1170/4885PKM 3199/4885
US-20210355119-A1 CYANO QUINOLINE AMIDE COMPOUNDS AS HER2 INHIBITORS AND METHODS OF USE ERBB2, EGFR, ERBB3 KIF11 3958/4885LMNA 1042/4885PKM 3243/4885

“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.