SCHEMBL5375493

SCHEMBL5375493

CCCCc1c(C[C@@H](N)C(=O)NCCc2ccccc2)c2ccccc2n1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TLR2 O60603 1/20 0.42
▸ AGTR1 P30556 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.40

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
SCHEMBL4024428 0.83 NPC1 (0.43) POLB
SCHEMBL4030977 0.74 EGFR (0.40) POLB
SCHEMBL8615413 0.73 DPP7 (0.60) KMT2ATLR2POLB
Hydrochloric Acid SCHEMBL8615285 0.72 DPP7 (0.59) MEN1KMT2ATLR2POLB
SCHEMBL5375489 0.72 TLR2 (0.43) CNR2MEN1KMT2ATLR2POLB
SCHEMBL14861105 0.72 CA12 (0.61) KMT2APOLBHDAC8
SCHEMBL6961215 0.72 CA12 (0.61) KMT2APOLBHDAC8
SCHEMBL13073331 0.72 CA12 (0.61) KMT2APOLBHDAC8
SCHEMBL987969 0.71 REN (0.60) —
SCHEMBL3409209 0.71 REN (0.60) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244743-B2 Non-peptidic BRS-3 agonists SOLVAY PHARMACEUTICALS GMBH (DE) 2007-07-17 — — US disclosed
US-20050171146-A1 Non-peptidic BRS-3 agonists SOLVAY PHARMACEUTICALS GMBH (DE) 2005-08-04 — — 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 (1 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-20050171146-A1 Non-peptidic BRS-3 agonists BRS3, NPR3, ADRB3 CNR2 142/4885MEN1 738/4885KMT2A 4148/4885

“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.

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