SCHEMBL22044746

SCHEMBL22044746

CCCCOC(=O)Cn1ncc2cc(-n3cccn3)c(C(C)=O)cc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 2/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
BRD4 O60885 1/20 0.33
GAA P10253 1/20 0.33
KCNH2 Q12809 1/20 0.33
PLA2G4A P47712 2/20 0.33
LMNA P02545 1/20 0.33
CNR1 P21554 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL22045489 0.86 SYK (0.39) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL30046479 0.86 SYK (0.39) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL22044745 0.84 KCNH2 (0.35) MEN1KMT2AMAPTGAAKCNH2
SCHEMBL30045875 0.84 KCNH2 (0.35) MEN1KMT2AMAPTGAAKCNH2
SCHEMBL21988960 0.82 KMO (0.44) MEN1KMT2AMAPTGAAKCNH2
SCHEMBL22046557 0.82 KCNH2 (0.35) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL21988835 0.77 KCNH2 (0.34) MEN1KMT2AMAPTNPC1GAA
SCHEMBL22044791 0.74 ALDH1A1 (0.40) MEN1KMT2AMAPTL3MBTL1RAB9A
SCHEMBL22045556 0.73 ALDH1A1 (0.39) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL17665507 0.72 MEN1 (0.58) MEN1KMT2AMAPTPOLBL3MBTL1

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
US-20230382892-A1 Chemical Compounds PFIZER INC. (US) 2023-11-30 US disclosed
US-11702405-B2 Chemical compounds PFIZER INC. (US) 2023-07-18 US disclosed
US-11014908-B2 Chemical compounds PFIZER INC. (US) 2021-05-25 US disclosed
US-20200172512-A1 Chemical Compounds PFIZER INC. (US) 2020-06-04 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 (4 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-20200172512-A1 Chemical Compounds HBZ, HBB, HBS1L MEN1 3178/4885KMT2A 3842/4885MAPT 305/4885
US-11702405-B2 Chemical compounds HBZ, HBB, HBS1L MEN1 3178/4885KMT2A 3842/4885MAPT 305/4885
US-20230382892-A1 Chemical Compounds HBZ, HBB, HBS1L MEN1 3178/4885KMT2A 3842/4885MAPT 305/4885
US-11014908-B2 Chemical compounds HBZ, HBB, HBS1L MEN1 3178/4885KMT2A 3842/4885MAPT 305/4885

“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.