SCHEMBL1426653

SCHEMBL1426653

N=C1CCCCCCCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.38
TRIM33 Q9UPN9 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32

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
SCHEMBL1425901 1.00
SCHEMBL10701192 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1TSHRCASP1
SCHEMBL22071458 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1TSHRCASP1
SCHEMBL1425884 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1TSHRCASP1
SCHEMBL3742910 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1TSHRCASP1
SCHEMBL1426217 1.00 TRIM24 (0.38) TRIM24TRIM33ALDH1A1TSHRCASP1
SCHEMBL111811 1.00
SCHEMBL9681639 0.96
Water SCHEMBL28367532 0.96
Hydrochloric Acid SCHEMBL28545155 0.96

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
US-8680267-B2 Process for producing amide or lactam DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-25 US disclosed
US-20110092699-A1 PROCESS FOR PRODUCING AMIDE OR LACTAM DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2011-04-21 US disclosed
EP-2301918-A1 PROCESS FOR PRODUCING AMIDE OR LACTAM Daicel Chemical Industries, Ltd. (JP) 2011-03-30 EP disclosed
US-20100029931-A1 METHOD FOR PRODUCING LACTAM COMPOUND SHIBAMOTO AKIHIRO 2010-02-04 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-20100029931-A1 METHOD FOR PRODUCING LACTAM COMPOUND COASY, OXA1L, SPOUT1 TRIM24 3886/4885TRIM33 2846/4885ALDH1A1 2495/4885
US-20110092699-A1 PROCESS FOR PRODUCING AMIDE OR LACTAM COASY, SULT1A1, SULT2A1 TRIM24 4357/4885TRIM33 4475/4885ALDH1A1 684/4885

“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.