SCHEMBL6669064

SCHEMBL6669064

O=C(Nc1cccc2c1CCN2C(=O)Cc1ccccn1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRPK1 Q96SB4 13/20 0.45
SORT1 Q99523 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
NTRK1 P04629 1/20 0.40
SMO Q99835 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
SCHEMBL6667845 0.92 SRPK1 (0.44) SRPK1SORT1ALDH1A1HTR2AHTR2C
SCHEMBL6799432 0.90 SMO (0.48) SRPK1SMO
SCHEMBL6667054 0.85 SORT1 (0.40) SRPK1SORT1HTR2AHTR2CHTR2B
SCHEMBL6664848 0.84 HTR2A (0.53) SRPK1SORT1HTR2AHTR2CHTR2B
SCHEMBL6663338 0.84 HTR2A (0.53) SORT1HTR2AHTR2CHTR2BSMO
SCHEMBL6806278 0.82 SMO (0.47) SRPK1NTRK1SMO
SCHEMBL6803527 0.76 SMO (0.47) SRPK1HTR2AHTR2CHTR2BSMO
SCHEMBL6805171 0.76 SMO (0.52) ALDH1A1HTR2AHTR2CHTR2BNTRK1
SCHEMBL6664745 0.76 EIF2AK3 (0.46) HTR2AHTR2CHTR2BSMO
SCHEMBL6635095 0.75 PARP1 (0.48) SRPK1SORT1HTR2AHTR2CHTR2B

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