SCHEMBL11201347

SCHEMBL11201347

Cc1ccc(Cc2c(C)cccc2-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 2/20 0.39
HTR7 P34969 3/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
RAB9A P51151 4/20 0.38
MAPK1 P28482 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
IDH1 O75874 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.37
C3AR1 Q16581 1/20 0.37
NPC1 O15118 3/20 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
SCHEMBL2991545 0.91 HTR7 (0.45) PDCD1CD274LMNAALDH1A1HTT
SCHEMBL11206708 0.82 CD274 (0.44) PDCD1CD274LMNAALDH1A1HTT
SCHEMBL11202177 0.81 POLB (0.37) PDCD1CD274LMNAALDH1A1HTT
SCHEMBL11435523 0.81 IDO1 (0.42) SMN1; SMN2RAB9AMAPK1TDP1POLB
SCHEMBL11197019 0.80 HTR7 (0.49) PDCD1CD274LMNAALDH1A1HTT
SCHEMBL11212389 0.78 NPC1 (0.47) ALDH1A1HTR7SMN1; SMN2RAB9AMAPK1
SCHEMBL9717406 0.77 PDCD1 (0.47) PDCD1CD274ALDH1A1HTR7SMN1; SMN2
SCHEMBL29699190 0.77 PDCD1 (0.47) PDCD1CD274ALDH1A1HTR7SMN1; SMN2
SCHEMBL11199823 0.77 THRB (0.36) PDCD1CD274LMNAALDH1A1HTT
SCHEMBL17697636 0.76 PDCD1 (0.55) PDCD1CD274ALDH1A1HTR7SMN1; SMN2

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-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed