SCHEMBL22845339

SCHEMBL22845339

O=C(c1ccc(Br)c(Cl)c1)N1CCc2c(n3ncc(Cc4ccccc4)c3n(-c3ccc(-n4cccn4)cc3)c2=O)C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.35
CXCR4 P61073 1/20 0.33
HTR1A P08908 4/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
USP7 Q93009 1/20 0.32
CHRM1 P11229 1/20 0.32
MTHFD2 P13995 1/20 0.31
KCNK3 O14649 1/20 0.31
AVPR2 P30518 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
ABCG2 Q9UNQ0 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
SCHEMBL24173421 0.92 ALDH1A1 (0.36) P2RX7PKMNPSR1MTHFD2KCNK3
SCHEMBL22845346 0.91 MGLL (0.36) P2RX7AVPR2LMNAMAPT
SCHEMBL22845517 0.91 CXCR4 (0.33) CXCR4MEN1POLBPKMKMT2A
SCHEMBL22845425 0.90 MTHFD2 (0.33) P2RX7PKMNPSR1MTHFD2ALDH1A1
SCHEMBL26842658 0.90 MAPT (0.35) P2RX7MEN1POLBKMT2AMTHFD2
SCHEMBL24469877 0.89 MGLL (0.39) P2RX7NPSR1MTHFD2KCNK3MAPT
SCHEMBL24469795 0.89 MGLL (0.37) P2RX7PKMUSP7MTHFD2ALDH1A1
SCHEMBL24483838 0.89 HDAC1 (0.35) P2RX7MTHFD2ALDH1A1LMNAGAA
SCHEMBL24469797 0.88 ALDH1A1 (0.33) P2RX7MTHFD2ALDH1A1LMNAMAPT
SCHEMBL22845445 0.87 MAPT (0.35) P2RX7ALDH1A1MAPT

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 6 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
WO-2022115384-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2022-06-02 WO disclosed
US-20220000874-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-01-06 US disclosed
US-11136321-B2 Tricyclic compounds ALIGOS THERAPEUTICS, INC. (US) 2021-10-05 US disclosed
US-20200407361-A1 TRICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2020-12-31 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-20220000874-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL P2RX7 2406/4885CXCR4 2515/4885HTR1A 1341/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL P2RX7 2406/4885CXCR4 2515/4885HTR1A 1341/4885
US-11820773-B2 Tricyclic compounds SLC10A1, PKD1, CEL P2RX7 2406/4885CXCR4 2515/4885HTR1A 1341/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL P2RX7 2406/4885CXCR4 2515/4885HTR1A 1341/4885

“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.