SCHEMBL8847372

SCHEMBL8847372

OCC1(c2ccc3ccccc3c2Br)CO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
TSHR P16473 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 4/20 0.37
RXFP1 Q9HBX9 3/20 0.36
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
NCEH1 Q6PIU2 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 3/20 0.34
NPC1 O15118 2/20 0.34
PRNP P04156 2/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 2/20 0.33
CYP2A6 P11509 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL8847345 0.83 POLB (0.39) POLBTSHRL3MBTL1RAB9ARXFP1
SCHEMBL11742168 0.80 SLC6A3 (0.42) TSHRMAPK1MAPTALDH1A1KDM4E
SCHEMBL3210989 0.71 POLB (0.42) POLBTSHRL3MBTL1RAB9AMAPK1
SCHEMBL3208639 0.71 POLB (0.39) POLBTSHRL3MBTL1RAB9ARXFP1
SCHEMBL6949129 0.70 CYP2A6 (0.34) RXFP1MAPTALDH1A1KDM4ECYP2A6
SCHEMBL3213344 0.69 POLB (0.40) POLBTSHRL3MBTL1RAB9AMAPK1
SCHEMBL596646 0.66 POLB (0.57) POLBTSHRRAB9ARXFP1NCEH1
SCHEMBL8766885 0.64 GAA (0.39) TSHRL3MBTL1RAB9AMAPK1SMN1; SMN2
SCHEMBL2012787 0.62 POLB (0.52) POLBTSHRRAB9ARXFP1NCEH1
Acetic Acid SCHEMBL10391565 0.62 POLB (0.47) POLBRAB9ARXFP1TP53MAPK1

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
EP-0605937-B1 Antistatic resin composition DAISO CO LTD (JP) 1997-06-11 EP claimed