O-Xylene

O-Xylene

SCHEMBL813587

CCCCCCCCCCCCN(CCCCCCCCCCCC)C(N)=O.Cc1ccccc1C

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.51
NPC1 O15118 1/20 0.44
JAK2 O60674 1/20 0.44
RAB9A P51151 1/20 0.44
PAX8 Q06710 1/20 0.44
TACR1 P25103 1/20 0.43
P2RX7 Q99572 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CNR2 P34972 1/20 0.43
ICMT O60725 1/20 0.42
ALB P02768 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42

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 SCHEMBL813808 1.00 ALDH1A1 (0.51) ALDH1A1TP53NPC1JAK2RAB9A
O-Xylene SCHEMBL814568 1.00 ALDH1A1 (0.51) ALDH1A1TP53NPC1JAK2RAB9A
O-Xylene SCHEMBL813552 1.00 ALDH1A1 (0.51) ALDH1A1TP53NPC1JAK2RAB9A
Toluene SCHEMBL27839323 0.89 CNR2 (0.48) ALDH1A1TP53NPC1JAK2RAB9A
Benzene SCHEMBL27712389 0.86 CA12 (0.45) ALDH1A1NPC1JAK2RAB9APAX8
Diphenylmethane SCHEMBL5889095 0.84 KCNH2 (0.50) NPC1JAK2RAB9APAX8TACR1
Diphenylmethane SCHEMBL3984520 0.84 KCNH2 (0.50) NPC1JAK2RAB9APAX8TACR1
SCHEMBL25271587 0.84 CA12 (0.50) ALDH1A1TP53CA12CA1CA2
SCHEMBL25228718 0.84 CA12 (0.50) ALDH1A1TP53CA12CA1CA2
SCHEMBL25226761 0.84 CA12 (0.50) ALDH1A1TP53CA12CA1CA2

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-2199052-B1 PROCESS FOR PRODUCTION OF INJECTION-MOLDED ARTICLE OF POLYLACTIC ACID RESIN KAO CORP (JP) 2014-01-22 EP disclosed
US-8062574-B2 Process for production of injection-molded article of polylactic acid resin KAO CORPORATION (JP) 2011-11-22 US disclosed
US-20100201037-A1 PROCESS FOR PRODUCTION OF INJECTION-MOLDED ARTICLE OF POLYLACTIC ACID RESIN KAO CORPORATION (JP) 2010-08-12 US disclosed
EP-2199052-A1 PROCESS FOR PRODUCTION OF INJECTION-MOLDED ARTICLE OF POLYLACTIC ACID RESIN Kao Corporation (JP) 2010-06-23 EP disclosed