SCHEMBL22845224

SCHEMBL22845224

O=c1[nH]c2c(Cc3ccc(OC(F)(F)F)cc3)cnn2c2c1CCNC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAT P00750 4/20 0.42
HTR2C P28335 3/20 0.42
GCGR P47871 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
WNT3A P56704 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA3 P34903 1/20 0.34
MPO P05164 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
SLC6A4 P31645 1/20 0.33
CDK8 P49336 1/20 0.33
NTRK3 Q16288 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
EGLN1 Q9GZT9 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
SCHEMBL24174321 0.83 HTR2C (0.46) PLATHTR2CHTR2AHTR2B
SCHEMBL22845220 0.79 ABHD6 (0.39) PLATGCGRTNKS2POLBMAPT
SCHEMBL22845314 0.73 GCGR (0.41) PLATHTR2CGCGRSLC6A4NTRK3
SCHEMBL24484006 0.72 PLAT (0.33) PLAT
SCHEMBL24469873 0.65 PDE3B (0.37) PLATHTR2C
SCHEMBL22717415 0.65 GPR119 (0.42) TNKS2CDK8
SCHEMBL24469986 0.65 PDE3B (0.36) PLATHTR2C
SCHEMBL24469807 0.64 P2RX3 (0.43) TNKS2
SCHEMBL22845210 0.63 ALDH1A1 (0.42) HTR2CHTR2APOLB
SCHEMBL22845219 0.62 HTR2C (0.39) HTR2CHTR2AHTR2B

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-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 (3 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 PLAT 2546/4885HTR2C 467/4885GCGR 1314/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL PLAT 2546/4885HTR2C 467/4885GCGR 1314/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL PLAT 2546/4885HTR2C 467/4885GCGR 1314/4885

“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.