SCHEMBL5026464

SCHEMBL5026464

Fc1ccc2[nH]c3c(c2c1Cl)CCC3

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.52
MAPT P10636 6/20 0.41
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
LMNA P02545 4/20 0.36
TP53 P04637 2/20 0.36
EGFR P00533 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
F2 P00734 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL6625805 0.83 MAPT (0.44) ARMAPTLMNATP53EGFR
SCHEMBL5017970 0.81 MAPT (0.42) ARMAPTLMNATP53EGFR
SCHEMBL2359673 0.78 KDM4E (0.57) ARMAPTHTR2AHTR2CHTR2B
SCHEMBL5025185 0.76 MAPT (0.39) ARMAPTLMNATP53EGFR
SCHEMBL4901767 0.73 AR (0.39) ARHTR2AHTR2CHTR2B
SCHEMBL4909034 0.72 SIRT1 (0.55) ARMAPTALOX15MAPK1SMN1; SMN2
SCHEMBL4895997 0.72 SIRT1 (0.44) ARMEN1KMT2A
SCHEMBL4029160 0.72 GFER (0.47) MAPTLMNATP53EGFRKDM4E
SCHEMBL2359349 0.71 AR (0.50) ARMAPTHTR2AHTR2CLMNA
SCHEMBL4148253 0.71 MAPT (0.56) MAPTLMNATP53EGFRKDM4E

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-2510949-A1 THERAPEUTIC AGENT FOR FIBROMYALGIA Astellas Pharma Inc. (JP) 2012-10-17 EP disclosed
EP-1328515-B1 INDOLINE DERIVATIVES AND THEIR USE AS 5-HT2 RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2008-08-06 EP disclosed