SCHEMBL19034740

SCHEMBL19034740

COc1cc(C)cc(-c2cc(C)cc(O)c2OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.59
▸ MAPT P10636 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ POLB P06746 2/20 0.50
▸ RECQL P46063 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ APEX1 P27695 1/20 0.50
▸ MPI P34949 1/20 0.50
▸ CYP3A4 P08684 1/20 0.47
▸ PTPN1 P18031 1/20 0.46
▸ TPMT P51580 1/20 0.44
▸ PIM1 P11309 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43
▸ ERN1 O75460 1/20 0.41
▸ GLA P06280 1/20 0.40
▸ ELANE P08246 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40

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
SCHEMBL8084791 0.90 TDP1 (0.52) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL1427958 0.88 ACHE (0.70) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL29421895 0.88 ACHE (0.70) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL17655758 0.88 ACHE (0.76) ACHEMAPTALDH1A1KMT2ACYP3A4
SCHEMBL16091526 0.85 ACHE (0.59) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL11406884 0.81 MAOB (0.50) ACHEMAPTKMT2APOLBGAA
SCHEMBL28616326 0.80 MAPT (0.50) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL68928 0.79 TDP1 (0.67) ACHEMAPTKDM4EALDH1A1KMT2A
SCHEMBL19351317 0.77 ACHE (0.59) ACHEMAPTKMT2ACYP3A4ERN1
SCHEMBL20109779 0.77 ACHE (0.53) ACHEMAPTKMT2ACYP3A4MEN1

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-9687829-B2 Catalyst for pyrolysis of feedstock BASF CORPORATION (US) 2017-06-27 — — US disclosed
Send feedback