SCHEMBL882809

SCHEMBL882809

CCCC(=O)Nc1cccc(NC(=O)c2ccccc2F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2R P25116 13/20 1.00
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
MAPT P10636 1/20 0.62
MAPK1 P28482 1/20 0.62

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
SCHEMBL882806 0.85 F2R (1.00) F2RNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL882721 0.85 F2R (1.00) F2RKMT2A
SCHEMBL882467 0.84 F2R (1.00) F2RKMT2A
SCHEMBL29766853 0.84 F2R (1.00) F2RKMT2A
SCHEMBL882797 0.84 F2R (1.00) F2RNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL882775 0.83 F2R (1.00) F2R
SCHEMBL10975643 0.82 F2R (0.73) F2RRAB9AMAPT
SCHEMBL882763 0.82 F2R (0.70) F2RKDM4E
SCHEMBL10069479 0.82 KCNK3 (0.77) F2RKMT2AMAPTMAPK1
SCHEMBL882759 0.82 F2R (0.70) F2RKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9422262-B2 Compounds and methods for treating diseases mediated by protease activated receptors THE BROAD INSTITUTE, INC. (US) 2016-08-23 US disclosed
US-9422262-B2 Compounds and methods for treating diseases mediated by protease activated receptors THE BROAD INSTITUTE, INC. (US) 2016-08-23 US disclosed
WO-2012040636-A2 COMPOUNDS AND METHODS FOR TREATING DISEASES MEDIATED BY PROTEASE ACTIVATED RECEPTORS THE BROAD INSTITUTE, INC. (US) 2012-03-29 WO disclosed