SCHEMBL7842860

SCHEMBL7842860

Cc1cccc2[nH]cc(C(=O)CCl)c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ CTNNB1 P35222 3/20 0.51
▸ WNT3A P56704 3/20 0.51
▸ GPR84 Q9NQS5 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ MITF O75030 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ NR4A2 P43354 1/20 0.46
▸ NPC1 O15118 2/20 0.43
▸ ADAM17 P78536 1/20 0.41
▸ BRPF1 P55201 1/20 0.40
▸ PBRM1 Q86U86 1/20 0.39
▸ MAP3K7 O43318 1/20 0.39
▸ TAB1 Q15750 1/20 0.39
▸ KDM1A O60341 1/20 0.39

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
SCHEMBL16791407 0.83 GPR84 (0.49) CTNNB1WNT3AGPR84ALDH1A1KMT2A
SCHEMBL7849247 0.83 NR4A2 (0.61) LMNARAB9ACTNNB1WNT3AGPR84
SCHEMBL11795053 0.82 GPR84 (0.50) CTNNB1WNT3AGPR84ALDH1A1KMT2A
SCHEMBL8568555 0.81 LMNA (0.47) LMNARAB9ACTNNB1WNT3AALDH1A1
SCHEMBL3995494 0.80 GPR84 (0.51) CTNNB1WNT3AGPR84ALDH1A1KMT2A
SCHEMBL15356576 0.80 PBRM1 (0.56) LMNACTNNB1WNT3AGPR84ALDH1A1
SCHEMBL7845184 0.80 NR4A2 (0.62) LMNARAB9ACTNNB1WNT3AALDH1A1
SCHEMBL17341969 0.80 CTNNB1 (0.50) LMNACTNNB1WNT3AGPR84ALDH1A1
SCHEMBL17341982 0.80 CTNNB1 (0.50) CTNNB1WNT3AGPR84ALDH1A1KMT2A
SCHEMBL23538240 0.79 GPR84 (0.47) RAB9ACTNNB1WNT3AGPR84ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915280-B2 Compounds and their uses EISAI INC. (US) 2011-03-29 — — US disclosed
EP-0821685-B1 INDOLE-3-CARBONYL AND INDOLE-3-SULFONYL DERIVATIVES AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 2001-10-04 — — EP disclosed
EP-0821685-A1 INDOLE-3-CARBONYL AND INDOLE-3-SULFONYL DERIVATIVES AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1998-02-04 — — EP disclosed
WO-1996033196-A1 INDOLE-3-CARBONYL AND INDOLE-3-SULFONYL DERIVATIVES AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1996-10-24 — — WO disclosed
US-5567711-A Indole-3-carbonyl and indole-3-sulfonyl derivatives as platelet activating factor antagonists ABBOTT LABORATORIES (US) 1996-10-22 — — US disclosed
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