SCHEMBL6642755

SCHEMBL6642755

O=C(Nc1ccc2c(c1)CCCN2CCc1ccccn1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMO Q99835 3/20 0.49
▸ HTR2A P28223 2/20 0.44
▸ HTR2C P28335 2/20 0.44
▸ HTR2B P41595 2/20 0.44
▸ SRPK1 Q96SB4 5/20 0.42
▸ MTTP P55157 4/20 0.42
▸ APOB P04114 3/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SORT1 Q99523 1/20 0.41
▸ CREBBP Q92793 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ LPL P06858 1/20 0.40
▸ LIPC P11150 1/20 0.40
▸ LIPG Q9Y5X9 1/20 0.40

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
SCHEMBL6666524 0.95 SMO (0.51) SMOHTR2AHTR2CHTR2BSRPK1
SCHEMBL6803431 0.92 SMO (0.60) SMOMTTPAPOBLMNATP53
SCHEMBL6666013 0.89 SMO (0.51) SMOHTR2AHTR2CHTR2BSRPK1
SCHEMBL6669784 0.88 SMO (0.53) SMOHTR2AHTR2CHTR2BSRPK1
SCHEMBL6666569 0.88 SMO (0.44) SMOHTR2AHTR2CHTR2BSRPK1
SCHEMBL6799860 0.87 SMO (0.61) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6665241 0.85 SMO (0.52) SMOHTR2AHTR2CHTR2BMTTP
SCHEMBL6663893 0.83 APOB (0.45) SMOMTTPAPOBLMNA
SCHEMBL6664848 0.83 HTR2A (0.53) SMOHTR2AHTR2CHTR2BSRPK1
SCHEMBL6667139 0.82 SMO (0.52) SMOMTTPAPOB

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 2 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 disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 — — WO disclosed
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