SCHEMBL9268985

SCHEMBL9268985

C=CCc1ccc(O)c(O)c1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.50
GABRB2 P47870 4/20 0.50
POLB P06746 2/20 0.43
AKR1B1 P15121 2/20 0.42
XDH P47989 2/20 0.42
GAA P10253 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 2/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH2 P05091 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALOX5 P09917 2/20 0.40
GABRB1 P18505 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
SCHEMBL10480235 0.82 GABRA1 (0.48) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL9637283 0.82 POLB (0.46) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL978929 0.81 GABRA1 (0.55) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL7943871 0.78 GABRA1 (0.52) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL9994577 0.76 HSPA5 (0.39) MAPTKMT2AMEN1HPGDCYP3A4
SCHEMBL1050874 0.76 GABRA1 (0.50) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL28806425 0.76 GABRA1 (0.50) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL174595 0.76 GABRA1 (0.55) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL15676646 0.75 GABRA1 (0.64) GABRA1GABRB2POLBAKR1B1XDH
SCHEMBL3819967 0.73 GABRA1 (0.68) GABRA1GABRB2POLBAKR1B1XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991004312-A1 ALKYLAMINE COMPLEXES OF BORATED ALKYL CATECHOLS AND LUBRICATING OIL COMPOSITIONS CONTAINING THE SAME CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1991-04-04 WO claimed
EP-0491856-B1 ALKYLAMINE COMPLEXES OF BORATED ALKYL CATECHOLS AND LUBRICATING OIL COMPOSITIONS CONTAINING THE SAME CHEVRON USA INC (US) 1995-08-09 EP disclosed
EP-0491856-A4 ALKYLAMINE COMPLEXES OF BORATED ALKYL CATECHOLS AND LUBRICATING OIL COMPOSITIONS CONTAINING THE SAME 1992-08-26 EP disclosed
EP-0491856-A1 ALKYLAMINE COMPLEXES OF BORATED ALKYL CATECHOLS AND LUBRICATING OIL COMPOSITIONS CONTAINING THE SAME. CHEVRON RES & TECH (US) 1992-07-01 EP disclosed
WO-1991004312-A1 ALKYLAMINE COMPLEXES OF BORATED ALKYL CATECHOLS AND LUBRICATING OIL COMPOSITIONS CONTAINING THE SAME CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1991-04-04 WO disclosed