SCHEMBL29273417

SCHEMBL29273417

Cc1nn2c(Br)c(C(=O)O)ccc2c1-c1c(F)cccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.36
▸ RORC P51449 8/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PDE2A O00408 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ SLC22A12 Q96S37 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ ELANE P08246 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ EIF4E P06730 1/20 0.34

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
SCHEMBL29273410 0.92 ALDH1A1 (0.37) NOTUMRORCELANE
SCHEMBL30933439 0.88 ALDH1A1 (0.36) LMNAKMT2AMEN1
SCHEMBL23355444 0.88 ALDH1A1 (0.36) LMNAKMT2AMEN1
SCHEMBL23355481 0.79 PIK3C2B (0.42) RORCLMNAPDE2AKMT2AL3MBTL1
SCHEMBL30933431 0.79 PIK3C2B (0.42) RORCLMNAPDE2AKMT2AL3MBTL1
SCHEMBL23355443 0.79 KMT2A (0.38) RORCLMNAKMT2AELANEL3MBTL1
SCHEMBL23355438 0.75 PDE4B (0.35) NOTUMRORCELANE
SCHEMBL29273416 0.74 RORC (0.41) RORCSLC22A12
SCHEMBL28618587 0.74 MAPT (0.40) LMNAKMT2AL3MBTL1MEN1
SCHEMBL19464235 0.72 MAPT (0.41) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112996788-B Anthelmintic heterocyclic compounds 勃林格殷格翰动物保健美国公司 2024-07-16 — — CN disclosed
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