SCHEMBL6557536

SCHEMBL6557536

CCC(=NO)c1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
MAPT P10636 2/20 0.54
HTT P42858 1/20 0.54
HPGD P15428 5/20 0.53
MGLL Q99685 3/20 0.51
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 4/20 0.42
ALDH1A1 P00352 4/20 0.42
ATM Q13315 1/20 0.42
TYR P14679 1/20 0.41
TSHR P16473 3/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HMGB1 P09429 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
SCHEMBL8665323 1.00 KDM4E (0.54) KDM4EMAPTHTTHPGDMGLL
SCHEMBL10780914 0.82 KDM4E (0.53) KDM4EMAPTHTTHPGDMEN1
SCHEMBL2317476 0.82 KDM4E (0.57) KDM4EMAPTHTTHPGDMEN1
SCHEMBL10780902 0.82 KDM4E (0.53) KDM4EMAPTHTTHPGDMEN1
SCHEMBL363988 0.79 ATM (0.47) HPGDMGLLMEN1KMT2AGAA
SCHEMBL27588810 0.79 KDM4E (0.50) KDM4EMAPTHTTHPGDMEN1
SCHEMBL24661575 0.78 SMN1; SMN2 (0.43) HPGDMGLLNPC1ALDH1A1ATM
SCHEMBL15164586 0.78 SMN1; SMN2 (0.43) HPGDMGLLNPC1ALDH1A1ATM
SCHEMBL15164588 0.78 MGLL (0.50) KDM4EMAPTHPGDMGLLMEN1
SCHEMBL12253472 0.78 ALDH1A1 (0.46) KDM4EMAPTHTTHPGDMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106243000-B A kind of Valinamide carbamate derivatives of base containing propynyloxy and application 南开大学 2017-12-05 CN disclosed
CN-106243000-A A kind of Valinamide carbamate derivatives containing propargyl epoxide and application 南开大学 2016-12-21 CN disclosed
EP-1098912-B1 INHIBITING SCALE IN VINYL MONOMER POLYMERIZATION OXY VINYLS LP (US) 2004-03-10 EP disclosed
US-6506854-B2 Antiscaling agent consists of a solvent; a reaction product of an aromatic compound containing benzene or napthalene ring substituted with hydroxy, mercaptan, sulfide etc, a carbonyl monomer and a thiourea; sodium hydroxide and sodium chloride OCCIDENTAL CHEMICAL CORPORATION 2003-01-14 US disclosed
US-20020015692-A1 Inhibiting scale in vinyl monomer polymerization OCCIDENTAL CHEMICAL CORP. 2002-02-07 US disclosed
US-6300427-B1 USED TO PREVENT FORMATION OF SCALE ON REACTOR SURFACES OCCIDENTAL CHEMICAL CORPORATION 2001-10-09 US disclosed
EP-1098912-A1 INHIBITING SCALE IN VINYL MONOMER POLYMERIZATION Oxy Vinyls L.P. (US) 2001-05-16 EP disclosed
US-6114476-A CONTACTING MONOMER WITH TERPOLYMER WHICH COMPRISES THE CONDENSATION REACTION PRODUCT OF AN AROMATIC COMPOUND, A CARBONYL COMPOUND, AND A THIOUREA OCCIDENTAL CHEMICAL CORPORATION (US) 2000-09-05 US disclosed
WO-2000009570-A1 INHIBITING SCALE IN VINYL MONOMER POLYMERIZATION OXY VINYLS, L.P. (US) 2000-02-24 WO disclosed
US-5786374-A FUNGICIDES, MICROBIOCIDES NOVARTIS CORPORATION (US) 1998-07-28 US disclosed
WO-1996014305-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 1996-05-17 WO disclosed
WO-1995001157-A1 USE OF HYDROXYPHENYL OXIMES AS CHELATING PHOTOPROTECTANTS THE PROCTER & GAMBLE COMPANY (US) 1995-01-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020015692-A1 Inhibiting scale in vinyl monomer polymerization TST, RTCB, ALK KDM4E 1790/4885MAPT 3974/4885HTT 1583/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.