SCHEMBL22845269

SCHEMBL22845269

COc1ccc(-n2c(=O)c3c(n4ncc(Cc5ccccc5)c24)CN(Cc2ccc(OC)c(OC)c2)CC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 4/20 0.43
TP53 P04637 4/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.41
CLPP Q16740 2/20 0.41
REV1 Q9UBZ9 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL22845227 0.95 GNRHR (0.44) GNRHRTP53ALDH1A1CLPPREV1
SCHEMBL22845204 0.85 GNRHR (0.44) GNRHRTP53ALDH1A1MEN1KMT2A
SCHEMBL22845483 0.83 GNRHR (0.44) GNRHRTP53ALDH1A1MEN1KMT2A
SCHEMBL24470066 0.80 ALDH1A1 (0.39) ALDH1A1LMNAMEN1KMT2AGAA
SCHEMBL22845374 0.80 GNRHR (0.45) GNRHRALDH1A1MEN1KMT2AGAA
SCHEMBL22845403 0.79 TP53 (0.45) GNRHRTP53ALDH1A1LMNAMEN1
SCHEMBL22845489 0.79 GNRHR (0.44) GNRHRALDH1A1LMNAREV1MEN1
SCHEMBL22845210 0.78 ALDH1A1 (0.42) GNRHRALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL22845209 0.76 MAPT (0.42) TP53ALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL22845396 0.76 GNRHR (0.44) GNRHRALDH1A1MEN1KMT2AGAA

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 GNRHR 2198/4885TP53 1710/4885ALDH1A1 648/4885
US-11136321-B2 Tricyclic compounds SLC10A1, PKD1, CEL GNRHR 2198/4885TP53 1710/4885ALDH1A1 648/4885
US-20200407361-A1 TRICYCLIC COMPOUNDS SLC10A1, PKD1, CEL GNRHR 2198/4885TP53 1710/4885ALDH1A1 648/4885

“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.