SCHEMBL30180274

SCHEMBL30180274

CC(O)c1ccc(-c2ccccc2C(=O)O)cn1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 15/20 0.50
LTB4R2 Q9NPC1 3/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL6885145 0.79 NPC1 (0.42) NPC1RAB9A
SCHEMBL21050082 0.78 NPC1 (0.55) BRS3LTB4R2NPC1GAARAB9A
SCHEMBL29743599 0.78 NPC1 (0.55) BRS3LTB4R2NPC1GAARAB9A
SCHEMBL30240830 0.74 DHODH (0.58) BRS3NPC1GAARAB9AKMT2A
SCHEMBL28675025 0.74 GAA (0.54) BRS3NPC1GAARAB9AKMT2A
SCHEMBL30292805 0.74 HNF4A (0.63) LTB4R2NPC1RAB9AKMT2A
SCHEMBL18759613 0.74 HNF4A (0.63) LTB4R2NPC1RAB9AKMT2A
SCHEMBL1874313 0.74 PRKAG1 (0.53) BRS3NPC1GAARAB9AKMT2A
SCHEMBL31143095 0.74 PIM1 (0.40) NPC1RAB9A
SCHEMBL17436209 0.72 ALDH1A1 (0.47) BRS3NPC1GAARAB9AKMT2A

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-12023319-B2 Carboxylic acid aromatic amides BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2024-07-02 US disclosed
US-20230043209-A1 CARBOXYLIC ACID AROMATIC AMIDES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2023-02-09 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 (2 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-12023319-B2 Carboxylic acid aromatic amides DDC, PAH, NAT1 BRS3 3116/4885LTB4R2 3279/4885NPC1 1233/4885
US-20230043209-A1 CARBOXYLIC ACID AROMATIC AMIDES DDC, PAH, NAT1 BRS3 3116/4885LTB4R2 3279/4885NPC1 1233/4885

“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.