SCHEMBL24469898

SCHEMBL24469898

Cc1nnc(-c2ccc(-n3c(=O)c4c(n5ncc(Cc6ccccc6)c35)CN(C(=O)c3ccc(Br)c(C(F)(F)F)c3)CC4)cc2)n1C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.33
MTHFD2 P13995 2/20 0.33
NR1H2 P55055 3/20 0.32
NR1H3 Q13133 3/20 0.32
AVPR2 P30518 2/20 0.31
AVPR1A P37288 2/20 0.31
KCNK3 O14649 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL24484039 0.93 MTHFD2 (0.30) MTHFD2
SCHEMBL24469881 0.91 MTHFD2 (0.33) P2RX7MTHFD2AVPR2AVPR1AKCNK3
SCHEMBL24469803 0.91 NR1H2 (0.32) P2RX7MTHFD2NR1H2NR1H3KCNK3
SCHEMBL24483898 0.90 P2RX7 (0.31) P2RX7
SCHEMBL26841980 0.89 NR1H2 (0.33) P2RX7MTHFD2NR1H2NR1H3KCNK3
SCHEMBL26841989 0.89 NR1H2 (0.33) P2RX7MTHFD2NR1H2NR1H3KCNK3
SCHEMBL24484050 0.89
SCHEMBL24483968 0.88 NR1H2 (0.32) P2RX7NR1H2NR1H3KCNK3
SCHEMBL24483821 0.88 SCD (0.34) P2RX7NR1H2NR1H3TP53
SCHEMBL24469859 0.88 NR1H2 (0.34) P2RX7MTHFD2NR1H2NR1H3KCNK3

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-11820773-B2 Tricyclic compounds ALIGOS THERAPEUTICS, INC. (US) 2023-11-21 US disclosed
US-11820773-B2 Tricyclic compounds ALIGOS THERAPEUTICS, INC. (US) 2023-11-21 US disclosed
US-20220169650-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-06-02 US disclosed
WO-2022115384-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2022-06-02 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 (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-20220169650-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL P2RX7 2406/4885MTHFD2 2383/4885NR1H2 477/4885
US-11820773-B2 Tricyclic compounds SLC10A1, PKD1, CEL P2RX7 2406/4885MTHFD2 2383/4885NR1H2 477/4885

“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.