SCHEMBL29599417

SCHEMBL29599417

c1cc2c(c3c1CCC3)OCC2

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.39
DAO P14920 1/20 0.37
KDM4C Q9H3R0 1/20 0.36
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
BCL2L1 Q07817 1/20 0.33
BAD Q92934 1/20 0.33
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
CES1 P23141 1/20 0.31
NLRP3 Q96P20 1/20 0.30
KIF11 P52732 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
SCHEMBL22743855 0.77 HTR2C (0.40) HTR2AHTR2CHTR2B
SCHEMBL17362278 0.77 MAOA (0.39) PARP1DAOKDM4CHTR2AHTR2C
SCHEMBL22743853 0.74 PNMT (0.40) HTR2AHTR2CHTR2B
SCHEMBL430270 0.74 MAOA (0.40) PARP1HTR2AHTR2CHTR2BCES1
SCHEMBL23944932 0.72 PARP1 (0.46) PARP1BCL2L1BADNOS3NOS1
SCHEMBL29599480 0.72 HTR2A (0.39) PARP1HTR2AHTR2CHTR2BBCL2L1
SCHEMBL805990 0.72 HTR2A (0.39) PARP1HTR2AHTR2CHTR2BBCL2L1
SCHEMBL428041 0.71 CES1 (0.37) BCL2L1BADNOS3NOS1NOS2
SCHEMBL428042 0.70 BCL2L1 (0.32) BCL2L1BADNOS3NOS1NOS2
SCHEMBL12327553 0.70 PARP1 (0.39) PARP1DAO

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-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS ON TARGET THERAPEUTICS LLC 2025-06-05 US disclosed
US-12060397-B2 Soluble lipidated ligand agents for treating eye inflammation TUFTS MEDICAL CENTER (US) 2024-08-13 US disclosed
US-20220135633-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS ON TARGET THERAPEUTICS LLC 2022-05-05 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-20220135633-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS LDLR, HDLBP, LIPG PARP1 4837/4885DAO 3469/4885KDM4C 4009/4885
US-20250179130-A1 METHODS AND SYSTEMS FOR DESIGNING AND/OR CHARACTERIZING SOLUBLE LIPIDATED LIGAND AGENTS LDLR, HDLBP, LIPG PARP1 4837/4885DAO 3469/4885KDM4C 4009/4885
US-12060397-B2 Soluble lipidated ligand agents for treating eye inflammation LIPG, CD40, LDLR PARP1 4669/4885DAO 3827/4885KDM4C 3437/4885

“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.