SCHEMBL6664848

SCHEMBL6664848

O=C(Nc1ccc2c(c1)CCN2C(=O)Cc1ccccn1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 6/20 0.53
▸ HTR2C P28335 6/20 0.53
▸ HTR2B P41595 5/20 0.53
▸ SMO Q99835 3/20 0.51
▸ EIF2AK3 Q9NZJ5 1/20 0.45
▸ SRPK1 Q96SB4 3/20 0.43
▸ MTTP P55157 3/20 0.43
▸ APOB P04114 2/20 0.43
▸ RIPK1 Q13546 1/20 0.42
▸ SORT1 Q99523 1/20 0.42
▸ NOTUM Q6P988 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
SCHEMBL6663338 0.94 HTR2A (0.53) HTR2AHTR2CHTR2BSMOMTTP
SCHEMBL6664745 0.91 EIF2AK3 (0.46) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6804688 0.91 SMO (0.61) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6804505 0.91 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6805171 0.90 SMO (0.52) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6646377 0.90 HTR2A (0.55) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6664314 0.90 SMO (0.47) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6667572 0.89 HTR2A (0.43) HTR2AHTR2CHTR2BSMOEIF2AK3
SCHEMBL6663855 0.88 SRPK1 (0.43) HTR2AHTR2CHTR2BSMOSRPK1
SCHEMBL6665118 0.88 RIPK1 (0.43) HTR2AHTR2CHTR2BSMOEIF2AK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 — — EP claimed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 — — WO claimed
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 — — EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 — — WO disclosed
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