SCHEMBL5380950

SCHEMBL5380950

CCCc1cc(Cc2cc(CC)c(N)c(CCC)c2)cc(CC)c1N

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DHFR P00374 7/20 0.44
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
BACE1 P56817 1/20 0.35
IKBKB O14920 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
SCHEMBL1100124 0.94 DHFR (0.41) DHFRPOLBHTTIKBKB
SCHEMBL48459 0.89 HTT (0.50) DHFRPOLBHTTBACE1
SCHEMBL3937871 0.88 POLB (0.40) DHFRPOLBHTTBACE1
SCHEMBL3945176 0.88 POLB (0.40) DHFRPOLBHTTBACE1
SCHEMBL5377222 0.86 SKP2 (0.39) DHFRHTT
SCHEMBL11497456 0.85 HTT (0.47) DHFRPOLBHTTBACE1
SCHEMBL11413476 0.84 SHBG (0.40) DHFRPOLBIKBKB
SCHEMBL31614612 0.82 DHFR (0.35) DHFRPOLBHTT
SCHEMBL6131303 0.82 GABRA1 (0.37) DHFRPOLBHTT
SCHEMBL8861189 0.82 SHBG (0.41) DHFRHTTIKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202359-B2 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2007-04-10 US disclosed
US-7084194-B2 Halogen-free resin composition CHANG CHUN PLASTICS CO., LTD. (TW) 2006-08-01 US disclosed
US-6900269-B2 Halogen-free resin composition CHANG CHUN PLASTICS CO., LTD. (TW) 2005-05-31 US disclosed
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2005-04-21 US disclosed
US-20040158023-A1 Halogen-free resin composition CHANG CHUN PLASTICS CO., LTD. (TW) 2004-08-12 US disclosed
US-20040147640-A1 Halogen-free resin composition CHANG CHUN PLASTICS CO., LTD. (TW) 2004-07-29 US disclosed
US-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2004-04-08 US disclosed
US-5686557-A Polyamide resin which can be dissolved in alcohol solvent, composition thereof, and method of use thereof TOMOEGAWA PAPER CO., LTD. (JP) 1997-11-11 US 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 (2 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-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 DHFR 1624/4885POLB 1238/4885HTT 2124/4885
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 DHFR 1297/4885POLB 1310/4885HTT 2082/4885

“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.