SCHEMBL21047653

SCHEMBL21047653

O=C1CCC(N(C2CCCCC2)C2CCCCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.41
TRIM33 Q9UPN9 2/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 2/20 0.39
ADH1A P07327 7/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
ADH1C P00326 5/20 0.35
PHGDH O43175 1/20 0.33
PKM P14618 1/20 0.33
ADH4 P08319 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
RECQL P46063 1/20 0.32
ADAM17 P78536 1/20 0.32
ADH1B P00325 1/20 0.31

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
SCHEMBL21047879 1.00 TRIM24 (0.41) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21047863 1.00 TRIM24 (0.41) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21047572 1.00 TRIM24 (0.41) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21047668 0.97 TRIM24 (0.38) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21047638 0.95 TRIM24 (0.40) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21047716 0.87 TRIM24 (0.35) TRIM24TRIM33ALDH1A1
SCHEMBL11007761 0.79 TRIM24 (0.36) TRIM24TRIM33ALDH1A1KMT2AADH1A
SCHEMBL21289754 0.78 ADH1A (0.43) ALDH1A1ADH1AADH1CPHGDHADH4
SCHEMBL65968 0.78 ADH1A (0.43) ALDH1A1ADH1AADH1CPHGDHADH4
SCHEMBL11277355 0.78 ADH1A (0.43) ALDH1A1ADH1AADH1CPHGDHADH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495341-B1 PREPARATION PROCESS OF PERFLUOROALKYL COMPOUND WITH MONOHYDROPERFLUOROALKANE AS STARTING MATERIAL KANTO DENKA KOGYO KK (JP) 2022-11-02 EP disclosed
CN-109563016-B Method for producing perfluoroalkyl compound using monohydroperfluoroalkane as starting material 关东电化工业株式会社 2022-05-13 CN disclosed
US-10450253-B2 Preparation process of perfluoroalkyl compound with monohydroperfluoroalkane as starting material KANTO DENKA KOGYO CO., LTD. (JP) 2019-10-22 US disclosed
EP-3495341-A1 METHOD FOR PRODUCING PERFLUOROALKYL COMPOUND USING MONOHYDROPERFLUOROALKANE AS STARTING MATERIAL Kanto Denka Kogyo Co., Ltd. (JP) 2019-06-12 EP disclosed
US-20190169107-A1 PREPARATION PROCESS OF PERFLUOROALKYL COMPOUND WITH MONOHYDROPERFLUOROALKANE AS STARTING MATERIAL NATIONAL UNIVERSITY CORPORATION GUNMA UNIVERSITY (JP) 2019-06-06 US disclosed
CN-109563016-A Using single hydrogen perfluoro alkane as the manufacturing method of the all-fluoroalkyl compound of starting material 关东电化工业株式会社 2019-04-02 CN 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-20190169107-A1 PREPARATION PROCESS OF PERFLUOROALKYL COMPOUND WITH MONOHYDROPERFLUOROALKANE AS STARTING MATERIAL PFKFB1, PFKFB4, PFAS TRIM24 2368/4885TRIM33 2869/4885ALDH1A1 505/4885
US-10450253-B2 Preparation process of perfluoroalkyl compound with monohydroperfluoroalkane as starting material PFKFB1, PFKFB4, PFAS TRIM24 2368/4885TRIM33 2869/4885ALDH1A1 505/4885

“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.