SCHEMBL28040262

SCHEMBL28040262

CCCCC(CCl)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.35
DNM1 Q05193 2/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 3/20 0.31

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
SCHEMBL28039816 0.85
SCHEMBL22161805 0.85 FDPS (0.40) FDPSDNM1TSHRTDP1ALDH1A1
SCHEMBL9052788 0.84 TSHR (0.38) FDPSDNM1TSHRTDP1ALDH1A1
SCHEMBL12651612 0.80 FDPS (0.38) FDPSDNM1TSHRTDP1ALDH1A1
SCHEMBL753539 0.80 FDPS (0.38) FDPSDNM1TSHRTDP1ALDH1A1
Hydrochloric Acid SCHEMBL9052786 0.78 FDPS (0.36) FDPSDNM1TSHRTDP1ALDH1A1
SCHEMBL27679510 0.78 FDPS (0.36) FDPSDNM1TSHRTDP1ALDH1A1
SCHEMBL14192118 0.78 FDPS (0.50) FDPSDNM1TSHR
SCHEMBL3802952 0.77 FDPS (0.43) FDPSDNM1TSHR
SCHEMBL20755804 0.76 FDPS (0.35) FDPSDNM1TDP1ALDH1A1

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
CN-105008331-B Act on multiple prostaglandin receptors, produce the compound of general anti-inflammatory response 阿勒根公司 2018-02-16 CN disclosed
CN-105008331-A COMPOUNDS ACT AT MULTIPLE PROSTAGLANDIN RECEPTORS GIVING A GENERAL ANTI-INFLAMMATORY RESPONSE ALLERGAN INC 2015-10-28 CN disclosed