SCHEMBL31451675

SCHEMBL31451675

Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cccc1-c1nc2ccc(Cl)cc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.61
▸ THRB P10828 3/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ TP53 P04637 6/20 0.58
▸ PPARG P37231 5/20 0.52
▸ TSHR P16473 2/20 0.51
▸ APOBEC3A P31941 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ APOBEC3G Q9HC16 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ PTGS2 P35354 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48

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
SCHEMBL31451577 0.93 MAPT (0.70) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451567 0.92 MAPT (0.60) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451486 0.89 MAPT (0.57) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451341 0.88 PPARG (0.50) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451534 0.86 MAPT (0.70) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451514 0.85 MAPT (0.69) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451417 0.85 MAPT (0.69) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451573 0.83 MAPT (0.66) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451706 0.81 MAPT (0.71) MAPTTHRBSMN1; SMN2TP53PPARG
SCHEMBL31451632 0.81 TP53 (0.57) MAPTTHRBSMN1; SMN2TP53TSHR

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
WO-2025054187-A1 TGR5 ANTAGONISTS AND METHODS OF USE Sanford Burnham Prebys Medical Discovery Institute (US) 2025-03-13 — — WO disclosed
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