SCHEMBL21024640

SCHEMBL21024640

CCCCCCC(CCCCC)c1nccn1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 2/20 0.39
TBXAS1 P24557 1/20 0.36
CYP2D6 P10635 1/20 0.35
LPO P22079 1/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
ALOX12 P18054 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33

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
SCHEMBL27895992 1.00 TLR8 (0.41) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL19087084 1.00 TLR8 (0.41) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL28717092 0.98 TLR8 (0.40) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL20098274 0.98 TLR8 (0.40) TLR8L3MBTL1ALDH1A1POLBKMT2A
Hydrochloric Acid SCHEMBL28717680 0.97 TLR8 (0.41) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL20372906 0.97 TLR8 (0.41) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL20994722 0.93 TLR8 (0.39) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL1854500 0.92 TLR8 (0.40) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL19582677 0.86 L3MBTL1 (0.40) TLR8L3MBTL1ALDH1A1POLBKMT2A
SCHEMBL28942503 0.85 L3MBTL1 (0.46) TLR8L3MBTL1ALDH1A1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11524963-B2 Substituted pyrazolo[3,4-d]pyrimidines as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2022-12-13 US disclosed
US-11008314-B2 Compounds and methods for modulating interleukin-2-inducible t-cell kinase CORVUS PHARMACEUTICALS, INC. (US) 2021-05-18 US disclosed
US-20200399279-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2020-12-24 US disclosed
US-10647711-B2 Azepin-2-one derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-05-12 US disclosed
US-20190152968-A1 AZEPIN-2-ONE DERIVATIVES AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-05-23 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 (5 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-20190152968-A1 AZEPIN-2-ONE DERIVATIVES AS RSV INHIBITORS AZI2, FURIN, ACE2 TLR8 2165/4885L3MBTL1 4854/4885ALDH1A1 1328/4885
US-11008314-B2 Compounds and methods for modulating interleukin-2-inducible t-cell kinase IL2, NFATC1, IL2RA TLR8 684/4885L3MBTL1 1737/4885ALDH1A1 3523/4885
US-20200399279-A1 SUBSTITUTED PYRAZOLO[3,4-d]PYRIMIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF TLR8 3790/4885L3MBTL1 1165/4885ALDH1A1 1787/4885
US-11524963-B2 Substituted pyrazolo[3,4-d]pyrimidines as RET kinase inhibitors RET, ROR1, BRAF TLR8 3744/4885L3MBTL1 1212/4885ALDH1A1 1752/4885
US-10647711-B2 Azepin-2-one derivatives as RSV inhibitors AZI2, FURIN, ACE2 TLR8 2165/4885L3MBTL1 4854/4885ALDH1A1 1328/4885

“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.