SCHEMBL28061550

SCHEMBL28061550

FC(F)(F)Oc1c[c]ccc1C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.42
SLC6A2 P23975 12/20 0.40
SLC6A4 P31645 12/20 0.40
SLC6A3 Q01959 11/20 0.40
HTR1A P08908 8/20 0.40
PLAT P00750 1/20 0.35

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
SCHEMBL28061558 0.92 HTR2A (0.40) HTR2CHTR1A
SCHEMBL28061588 0.92 HTR2A (0.40) HTR2CHTR1A
SCHEMBL8613370 0.89 DDB1 (0.31)
SCHEMBL614853 0.78 HTR2C (0.63) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL29691303 0.78 HTR2C (0.63) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL27964417 0.77 HTR2C (0.61) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
Hydrochloric Acid SCHEMBL4890789 0.77 HTR2C (0.64) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL28061555 0.77 JAK2 (0.37)
SCHEMBL17046383 0.76 DDB1 (0.31)
SCHEMBL28061580 0.75 RBP4 (0.42)

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
CN-105693645-B Condensed heterocyclic compouds as ion channel modulators 吉利德科学公司 2018-10-09 CN disclosed
CN-105693645-A FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS 吉利德科学公司 2016-06-22 CN disclosed
CN-103649056-B Fused heterocyclic compounds as modulators of ion channels GILEAD SCIENCES, INC. (US) 2016-04-27 CN disclosed