SCHEMBL21729101

SCHEMBL21729101

CCN(Cc1ncc[nH]1)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 5/20 0.43
SSTR4 P31391 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
CXCR4 P61073 1/20 0.39
HTR1A P08908 1/20 0.38
FDPS P14324 1/20 0.36
NLRP3 Q96P20 1/20 0.36
TBXAS1 P24557 2/20 0.35
CA14 Q9ULX7 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NAMPT P43490 1/20 0.35
PYGL P06737 1/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL27566333 0.83 CYP2D6 (0.50) TAAR1SSTR4L3MBTL1CXCR4CYP2D6
SCHEMBL1206770 0.82 SSTR4 (0.42) TAAR1SSTR4CXCR4HTR1ANAMPT
SCHEMBL1206318 0.81 CXCR4 (0.41) TAAR1SSTR4CXCR4HTR1AFDPS
SCHEMBL1206521 0.80 HDAC3 (0.47) TAAR1SSTR4CXCR4CYP2D6TSHR
SCHEMBL17145110 0.80 SSTR4 (0.38) TAAR1SSTR4CXCR4HTR1AFDPS
SCHEMBL13382331 0.80 TAAR1 (0.42) TAAR1L3MBTL1CXCR4HTR1AFDPS
SCHEMBL23928449 0.79 TAAR1 (0.53) TAAR1CXCR4HTR1AFDPSTBXAS1
SCHEMBL27585984 0.79 ADRA2A (0.51) TAAR1SSTR4HTR1ACYP2D6
SCHEMBL1204960 0.79 KDM4E (0.46) SSTR4CXCR4
SCHEMBL1204486 0.78 NR1D1 (0.45) L3MBTL1CXCR4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827597-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation INNATE TUMOR IMMUNITY, INC. (US) 2023-11-28 US disclosed
US-11827597-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation INNATE TUMOR IMMUNITY, INC. (US) 2023-11-28 US disclosed
US-11827597-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation INNATE TUMOR IMMUNITY, INC. (US) 2023-11-28 US disclosed
US-20230097144-A1 SUBSTITUTED 4-AMINO-1H-IMIDAZO[4,5-c]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION INNATE TUMOR IMMUNITY INC (US) 2023-03-30 US disclosed
US-20230097144-A1 SUBSTITUTED 4-AMINO-1H-IMIDAZO[4,5-c]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION INNATE TUMOR IMMUNITY INC (US) 2023-03-30 US disclosed
US-11572360-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation INNATE TUMOR IMMUNITY, INC. (US) 2023-02-07 US disclosed
US-11572360-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation INNATE TUMOR IMMUNITY, INC. (US) 2023-02-07 US disclosed
US-20210332040-A1 SUBSTITUTED 4-AMINO-1H-IMIDAZO[4,5-c]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION INNATE TUMOR IMMUNITY INC (US) 2021-10-28 US disclosed
WO-2020037094-A1 SUBSTITUED 4-AMINO-1H-IMIDAZO[4,5-C]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION INNATE TUMOR IMMUNITY, INC. (US) 2020-02-20 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 (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-20230097144-A1 SUBSTITUTED 4-AMINO-1H-IMIDAZO[4,5-c]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION NLRP3, NOD1, NLRP1 TAAR1 3273/4885SSTR4 3336/4885L3MBTL1 3341/4885
US-11827597-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation NLRP3, NOD1, NLRP1 TAAR1 3273/4885SSTR4 3336/4885L3MBTL1 3341/4885
US-11572360-B2 Substituted 4-amino-1H-imidazo[4,5-c]quinoline compounds and improved methods for their preparation NLRP3, NOD1, NLRP1 TAAR1 3273/4885SSTR4 3336/4885L3MBTL1 3341/4885
US-20210332040-A1 SUBSTITUTED 4-AMINO-1H-IMIDAZO[4,5-c]QUINOLINE COMPOUNDS AND IMPROVED METHODS FOR THEIR PREPARATION NLRP3, NOD1, NLRP1 TAAR1 3273/4885SSTR4 3336/4885L3MBTL1 3341/4885

“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.