SCHEMBL8974736

SCHEMBL8974736

C=C(C)c1ccccc1.ClC(Cl)=Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C1 Q04828 1/20 0.41
KDM1A O60341 1/20 0.41
RAB9A P51151 3/20 0.40
MTNR1A P48039 2/20 0.40
MTNR1B P49286 2/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FBP1 P09467 2/20 0.39
MEN1 O00255 1/20 0.38

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
SCHEMBL28274188 0.84 ALDH1A1 (0.45) ALDH1A1TSHRAKR1C3AKR1C1KDM1A
SCHEMBL40189 0.81 FBP1 (0.52) ALDH1A1TSHRAKR1C3AKR1C1KDM1A
SCHEMBL10697273 0.81 AKR1C1 (0.41) ALDH1A1TSHRAKR1C3AKR1C1KDM1A
SCHEMBL472891 0.78 CES2 (0.48) ALDH1A1TSHRMAPTKMT2ASMN1; SMN2
SCHEMBL2905282 0.78
Benzene SCHEMBL28197619 0.78 CES2 (0.48) ALDH1A1TSHRMAPTKMT2ASMN1; SMN2
Hydrogen Peroxide SCHEMBL7249472 0.78 CES2 (0.48) ALDH1A1TSHRMAPTKMT2ASMN1; SMN2
SCHEMBL1331472 0.78
SCHEMBL6577 0.78
SCHEMBL3267692 0.78 CES2 (0.48) ALDH1A1TSHRMAPTKMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0333879-B1 PROCESS FOR CONTINUOUSLY PRODUCING GRANULAR POLYMER AND PROCESS FOR CONTROLLING PARTICLE SIZE OF SAID POLYMER MITSUBISHI RAYON CO (JP) 1996-04-10 EP disclosed
US-5064938-A Coagulation slurrying MITSUBISHI RAYON CO., LTD. (JP) 1991-11-12 US disclosed
EP-0333879-A1 PROCESS FOR CONTINUOUSLY PRODUCING GRANULAR POLYMER AND PROCESS FOR CONTROLLING PARTICLE SIZE OF SAID POLYMER MITSUBISHI RAYON CO., LTD. (JP) 1989-09-27 EP disclosed