SCHEMBL4639899

SCHEMBL4639899

CCCC(C)(C)OC(=O)c1ccc(Br)cc1C(=O)OC(C)(C)CCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.38
HTT P42858 3/20 0.37
THRB P10828 1/20 0.37
MAPT P10636 4/20 0.37
RAB9A P51151 1/20 0.37
PTGDR2 Q9Y5Y4 2/20 0.36
POLB P06746 3/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
RECQL P46063 2/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
CCR6 P51684 1/20 0.36
KCNH2 Q12809 1/20 0.36
CES2 O00748 1/20 0.35
GALR3 O60755 1/20 0.35

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
SCHEMBL4639901 0.93 POLB (0.42) PTGDR2POLBALDH1A1SMN1; SMN2KDM4E
SCHEMBL4640160 0.90 HPGD (0.40) HPGDHTTTHRBMAPTRAB9A
SCHEMBL4643908 0.84 ESR1 (0.34) THRBALDH1A1KMT2AKDM4EMEN1
SCHEMBL4640163 0.84 POLB (0.45) HPGDHTTTHRBPOLBALDH1A1
SCHEMBL7191044 0.83 MAPT (0.35) HPGDMAPTRAB9APOLBALDH1A1
SCHEMBL4640059 0.83 TAS1R3 (0.36) HPGDRAB9AALDH1A1KMT2ASMN1; SMN2
SCHEMBL4641152 0.82 ALDH1A1 (0.33) ALDH1A1LMNAGABRA1GABRA3AR
SCHEMBL4640222 0.82 RIPK1 (0.36) HPGDRAB9AALDH1A1KMT2ASMN1; SMN2
SCHEMBL2280255 0.82 ELANE (0.43) HPGDHTTMAPTRAB9APOLB
SCHEMBL4628583 0.80 CES2 (0.41) HPGDRAB9APTGDR2ALDH1A1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1188739-B1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO LTD (JP) 2008-08-13 EP disclosed
US-6670497-B2 Dialkyl (at least one of which is a C4-8 tertiary alkyl) ester of an alkyl- or halo-substituted phthalic acid; used in an olefin polymerization catalyst TOHO TITANIUM CO., LTD. (JP) 2003-12-30 US disclosed
US-20030036594-A1 Phthalic diester derivatives and electron donors TOHO TITANIUM CO., LTD. (JP) 2003-02-20 US disclosed
EP-1188739-A1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO., LTD. (JP) 2002-03-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030036594-A1 Phthalic diester derivatives and electron donors HPD, ETFA, PPOX HPGD 9/4885HTT 730/4885THRB 4646/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.