Sugi Predict

Sugi Predict / Compounds / O-Xylene

O-Xylene

O-Xylene

SCHEMBL9150349

CC(C)CO.CCCCO.Cc1ccccc1C

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ TSHR P16473 3/20 0.40
▸ ACHE P22303 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ LMNA P02545 3/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ P2RX7 Q99572 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ SCN1A P35498 1/20 0.35
▸ SCN2A Q99250 1/20 0.35
▸ SCN3A Q9NY46 1/20 0.35
▸ GCGR P47871 1/20 0.35
▸ TRPA1 O75762 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 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
O-Xylene SCHEMBL9068205 0.90 ALDH1A1 (0.42) ALDH1A1TSHRACHESMN1; SMN2KDM4E
O-Xylene SCHEMBL195066 0.89 ALDH1A1 (0.55) ALDH1A1TSHRACHESMN1; SMN2KDM4E
O-Xylene SCHEMBL30279310 0.89 ALDH1A1 (0.55) ALDH1A1TSHRACHESMN1; SMN2KDM4E
O-Xylene SCHEMBL10683039 0.87 ALDH1A1 (0.52) ALDH1A1TSHRACHESMN1; SMN2KDM4E
O-Xylene SCHEMBL8391796 0.85 TSHR (0.56) ALDH1A1TSHRACHEKDM4ECYP1A2
O-Xylene SCHEMBL11032683 0.85 TSHR (0.56) ALDH1A1TSHRACHEKDM4ECYP1A2
O-Xylene SCHEMBL11035318 0.85 TSHR (0.56) ALDH1A1TSHRACHEKDM4ECYP1A2
O-Xylene SCHEMBL11033426 0.85 TSHR (0.56) ALDH1A1TSHRACHEKDM4ECYP1A2
O-Xylene SCHEMBL29084626 0.83 SMN1; SMN2 (0.57) ALDH1A1TSHRACHESMN1; SMN2LMNA
O-Xylene SCHEMBL11230054 0.83 ALDH1A1 (0.45) ALDH1A1TSHRSMN1; SMN2KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633814-A1 METHODS AND APPARATUS FOR REDUCING AIR ENTRAPMENT IN SPRAY APPLICATION OF COATINGS TO A SUBSTRATE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1995-01-18 — — EP disclosed
WO-1993019855-A1 METHODS AND APPARATUS FOR REDUCING AIR ENTRAPMENT IN SPRAY APPLICATION OF COATINGS TO A SUBSTRATE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-10-14 — — WO disclosed