SCHEMBL31065131

SCHEMBL31065131

COC(=O)c1c(Cl)ccc2[nH]ccc12

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 10/20 0.49
▸ ALOX5 P09917 2/20 0.44
▸ P2RX7 Q99572 2/20 0.43
▸ RHEB Q15382 1/20 0.42
▸ MTNR1A P48039 1/20 0.41
▸ MTNR1B P49286 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ PIM3 Q86V86 1/20 0.41
▸ CREBBP Q92793 1/20 0.41

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
SCHEMBL21643735 1.00 NR4A2 (0.49) NR4A2ALOX5P2RX7RHEBMTNR1A
SCHEMBL6421659 0.82 NR4A2 (0.49) NR4A2P2RX7MTNR1AMTNR1BPIM1
SCHEMBL3953673 0.81 MTNR1A (0.53) NR4A2P2RX7MTNR1AMTNR1BPIM1
SCHEMBL13987128 0.81 NR4A2 (0.47) NR4A2ALOX5P2RX7MTNR1AMTNR1B
SCHEMBL6421662 0.79 NR4A2 (0.43) NR4A2ALOX5P2RX7MTNR1AMTNR1B
SCHEMBL15797610 0.78 P2RX7 (0.50) NR4A2ALOX5P2RX7PIM1PIM3
SCHEMBL15797560 0.77 P2RX7 (0.54) NR4A2P2RX7CREBBP
SCHEMBL28730919 0.77 NR4A2 (0.50) NR4A2P2RX7PIM1PIM3CREBBP
SCHEMBL9938223 0.75 AXL (0.47) NR4A2
SCHEMBL31347303 0.75 AXL (0.47) NR4A2

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-112533581-B PRC1 inhibitors and methods of treatment therewith 密歇根大学董事会 2024-08-30 — — CN disclosed
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