SCHEMBL22246554

SCHEMBL22246554

CCc1ccc(NC(=O)Cn2cnc3ccccc32)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.69
HTT P42858 2/20 0.69
LMNA P02545 3/20 0.65
MGLL Q99685 1/20 0.64
TP53 P04637 3/20 0.60
POLB P06746 1/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
NPC1 O15118 2/20 0.60
KDM4E B2RXH2 1/20 0.60
MAPT P10636 2/20 0.58
RECQL P46063 1/20 0.58
PKM P14618 1/20 0.57
ORAI1 Q96D31 1/20 0.55
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
RAB9A P51151 1/20 0.54
GAA P10253 1/20 0.52
F2 P00734 2/20 0.52

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
SCHEMBL1036975 0.85 SMN1; SMN2 (0.68) SMN1; SMN2HTTLMNAMGLLL3MBTL1
SCHEMBL1038642 0.85 MGLL (0.70) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL3042348 0.84 SMN1; SMN2 (0.67) SMN1; SMN2HTTLMNAMGLLL3MBTL1
SCHEMBL13489998 0.79 SMN1; SMN2 (0.71) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL3038969 0.79 SMN1; SMN2 (1.00) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL1036943 0.79 MGLL (0.62) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL3032012 0.79 SMN1; SMN2 (0.81) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL1037303 0.78 SMN1; SMN2 (0.60) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL29754869 0.78 SMN1; SMN2 (0.66) SMN1; SMN2HTTLMNAMGLLPOLB
SCHEMBL3029076 0.78 SMN1; SMN2 (0.66) SMN1; SMN2HTTLMNAMGLLPOLB

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-20230106899-A1 METHODS OF TREATING CANCER NOVARTIS PHARMA AG (CH) 2023-04-06 US disclosed
WO-2020257621-A1 METHODS OF TREATING CANCER IFM DUE, INC. (US) 2020-12-24 WO disclosed
WO-2020150417-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2020-07-23 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-20230106899-A1 METHODS OF TREATING CANCER STING1, CGAS, TBK1 SMN1; SMN2 2644/4885HTT 3404/4885LMNA 1575/4885

“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.