SCHEMBL8916786

SCHEMBL8916786

Fc1cccc(F)c1-c1c(Cl)nc2ncnn2c1N1CCCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
NPSR1 Q6W5P4 3/20 0.40
GLA P06280 1/20 0.40
SMN1; SMN2 Q16637 6/20 0.39
LMNA P02545 4/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
KMT2A Q03164 3/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 4/20 0.37
PDE2A O00408 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
RECQL P46063 1/20 0.36
APP P05067 1/20 0.36

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
SCHEMBL4821987 1.00 TSHR (0.40) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL4820465 0.94 PDE2A (0.39) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL8916197 0.94 PDE2A (0.39) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL7488259 0.89 ALDH1A1 (0.37) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL4816609 0.89 ALDH1A1 (0.37) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL7490417 0.89 ALDH1A1 (0.37) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL4817364 0.89 TSHR (0.38) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL8912330 0.88 TSHR (0.41) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL974960 0.88 LMNA (0.36) TSHRNPSR1GLASMN1; SMN2LMNA
SCHEMBL4819802 0.88 LMNA (0.36) TSHRNPSR1GLASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5593996-A FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1997-01-14 US disclosed