SCHEMBL6246384

SCHEMBL6246384

CC(C)c1ccccc1-c1ccccc1OP(=O)(Oc1ccccc1-c1ccccc1C(C)C)Oc1ccccc1-c1ccccc1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
KMT2A Q03164 2/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAP2K7 O14733 1/20 0.35
GMNN O75496 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 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
SCHEMBL1410795 0.87 LMNA (0.36) LMNAKMT2ACA12CA1CA2
SCHEMBL6246385 0.86 INPPL1 (0.46) LMNAKMT2ACA12CA1CA2
SCHEMBL29352226 0.85 KMT2A (0.40) LMNAKMT2AKCNK3KCNK9GABRA1
SCHEMBL18252 0.85 KMT2A (0.40) LMNAKMT2AKCNK3KCNK9GABRA1
SCHEMBL3686336 0.83 LMNA (0.41) LMNAKMT2ACA12CA1CA2
SCHEMBL31105916 0.77 CYP3A4 (0.41) LMNAKMT2AKDM4ECYP1A2CYP3A4
SCHEMBL222391 0.77 CYP3A4 (0.41) LMNAKMT2AKDM4ECYP1A2CYP3A4
SCHEMBL223726 0.77 CYP3A4 (0.41) LMNAKMT2AKDM4ECYP1A2CYP3A4
SCHEMBL30524958 0.77 CYP3A4 (0.41) LMNAKMT2AKDM4ECYP1A2CYP3A4
SCHEMBL13232511 0.77 APP (0.48) LMNAKMT2ACA12CA1CA2

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
CN-111344323-A Reactive flame retardant blends for flexible polyurethane foams 爱思乐-艾博美国有限公司 2020-06-26 CN disclosed
EP-1164168-B1 THERMOPLASTIC RESIN COMPOSITION DAICEL CHEM (JP) 2005-07-27 EP disclosed
EP-1164168-A1 THERMOPLASTIC RESIN COMPOSITION Daicel Chemical Industries, Ltd. (JP) 2001-12-19 EP disclosed
US-4212832-A REACTING PHOSPHONIC OR PHOSPHORIC ACID ARYL ESTER WITH FORMALDEHYDE AND SULFURIC ACID; FLAME-PROOFING AGENT BAYER AKTIENGESELLSCHAFT (DE) 1980-07-15 US disclosed