SCHEMBL8634860

SCHEMBL8634860

CC(C)Oc1ccc(Sc2ccc(O)c(Br)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.39
BCL2 P10415 3/20 0.38
MCL1 Q07820 3/20 0.38
KMT2A Q03164 1/20 0.38
PARP10 Q53GL7 1/20 0.37
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALDH1A3 P47895 1/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
GLA P06280 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
SCHEMBL3537796 0.81 ALDH1A1 (0.47) KMT2APARP10ALOX15ALDH1A1POLB
SCHEMBL70601 0.79 ALOX15 (0.54) BCL2MCL1KMT2AALOX15ALDH1A1
SCHEMBL23917765 0.79 PTGIR (0.51) PTGIRKMT2APARP10ALDH1A1ALDH1A3
SCHEMBL8635450 0.78 ALDH1A1 (0.44) PTGIRKMT2APARP10ALOX15ALDH1A1
SCHEMBL20616409 0.78 PTGIR (0.46) PTGIRBCL2MCL1KMT2APARP10
SCHEMBL19847794 0.78 NR1H2 (0.56) PTGIRKMT2APARP10ALDH1A1ALDH1A3
SCHEMBL8633948 0.76 KMT2A (0.39) KMT2APARP10ALOX15ALDH1A1ALDH1A3
SCHEMBL8635590 0.75 POLB (0.45) ALDH1A1ALDH1A3POLBCYP1A2GAA
SCHEMBL8631823 0.74 ALOX15 (0.59) KMT2APARP10ALOX15ALDH1A1ALDH1A3
SCHEMBL8636447 0.74 PLAU (0.36) PTGIRKMT2AALDH1A1ALDH1A3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed