SCHEMBL6638020

SCHEMBL6638020

O=C(NNC(=O)c1ccccc1O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.74
RAB9A P51151 5/20 0.74
KDM4E B2RXH2 4/20 0.74
HTT P42858 2/20 0.74
CYP2C9 P11712 2/20 0.74
ALDH1A1 P00352 1/20 0.74
CYP2D6 P10635 1/20 0.74
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
CA1 P00915 2/20 0.65
CA9 Q16790 2/20 0.65
GAA P10253 2/20 0.61
L1CAM P32004 1/20 0.61
GSTA1 P08263 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MPO P05164 1/20 0.59
HIF1A Q16665 1/20 0.59
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
HPGD P15428 1/20 0.58

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
SCHEMBL77381 0.89 CA1 (0.77) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL11705569 0.85 KMT2A (0.76) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL14096514 0.85 KMT2A (1.00) KDM4EHTTALDH1A1MEN1KMT2A
SCHEMBL19032011 0.84 NPC1 (0.70) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL23978398 0.84 KDM4E (0.65) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL11325687 0.84 LMNA (0.75) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL11311422 0.83 RAB9A (0.67) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL400890 0.82 RAB9A (0.77) NPC1RAB9AKDM4ECYP2C9ALDH1A1
SCHEMBL6636585 0.82 CA1 (0.79) NPC1RAB9AKDM4EHTTCYP2C9
SCHEMBL11813318 0.82 ALDH1A1 (0.79) NPC1RAB9AKDM4ECYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107920973-B Surface modification composition 株式会社LG生活健康 2021-05-07 CN disclosed
EP-1420044-A2 Rubber composition and pneumatic tire Bridgestone Corporation (JP) 2004-05-19 EP disclosed
US-6380288-B1 LOW HEAT GENERATION PROPERTY, AGING REISTANCE, ALSO FOR PRODUCING VIBRATION ISOLATORS, BELTS AND HOSES AS WELL AS TIRE MATERIALS SUCH AS TIRE TREADS, UNDERTREADS, CARCASSES, SIDE WALLS AND BEADS BRIDGESTONE CORPORATION 2002-04-30 US disclosed
EP-0909788-A1 RUBBER COMPOSITION AND PNEUMATIC TIRES Bridgestone Corporation (JP) 1999-04-21 EP disclosed
US-4963605-A PHENOLIC DERIVATIVE, METAL DEACTIVATOR AND SULFUR-CONTAINING COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-10-16 US disclosed
US-4839408-A CONTAINING METAL DEACTIVATORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-13 US disclosed
EP-0222566-A2 Stabilised polyolefin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-05-20 EP disclosed
US-4338244-A HEAT AND OXIDATION RESISTANT POLYMERS SANDOZ LTD. (CH) 1982-07-06 US disclosed
US-4325863-A POLYMERS SANDOZ LTD. (CH) 1982-04-20 US disclosed
US-4052362-A N-CINNAMOYL-N'-ACYLHYDRAZINES UBE INDUSTRIES, LTD. (JA) 1977-10-04 US disclosed
US-4043976-A N,N'-DIBENZOYLHYDRAZINE DERIVATIVE UBE INDUSTRIES, LTD. (JA) 1977-08-23 US disclosed