SCHEMBL22339348

SCHEMBL22339348

Cc1n[nH]c2ccc(-c3ccc(C(C)(C)C)cc3)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.51
KIF11 P52732 3/20 0.50
MKNK1 Q9BUB5 1/20 0.49
GSK3B P49841 1/20 0.45
ALDH1A1 P00352 3/20 0.44
MITF O75030 1/20 0.44
TP53 P04637 1/20 0.44
KMT2A Q03164 1/20 0.44
JAK3 P52333 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
POLB P06746 1/20 0.42
ALOX15 P16050 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
XDH P47989 1/20 0.41
PDPK1 O15530 2/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL12907438 0.87 GSK3B (0.54) JAK2KIF11GSK3BALDH1A1MITF
SCHEMBL84539 0.86 KIF11 (0.47) JAK2KIF11GSK3BALDH1A1MITF
SCHEMBL12907189 0.84 JAK2 (0.66) JAK2ALDH1A1MITFTP53KMT2A
SCHEMBL19188029 0.83 JAK2 (0.57) JAK2MKNK1JAK3PDPK1PRKAG1
SCHEMBL27968550 0.81 MKNK1 (0.71) JAK2MKNK1GSK3BALDH1A1KDM4E
SCHEMBL12907439 0.80 MAPK1 (0.59) JAK2MKNK1GSK3BPDPK1PRKAG1
SCHEMBL11911447 0.79 KIF11 (0.46) JAK2KIF11MKNK1GSK3BALDH1A1
SCHEMBL11911446 0.79 JAK2 (0.42) JAK2KIF11MKNK1GSK3BALDH1A1
SCHEMBL11911448 0.79 GSK3B (0.47) JAK2KIF11MKNK1GSK3BALDH1A1
SCHEMBL11911444 0.78 PRKAG1 (0.67) JAK2GSK3BJAK3PRKAG1PRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067641-A1 INHIBITORS OF TRIM33 AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-02-29 US disclosed
US-20240067641-A1 INHIBITORS OF TRIM33 AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-02-29 US disclosed
US-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
US-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
US-20200255422-A1 INHIBITORS OF TRIM33 AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-08-13 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 (3 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-11731967-B2 Inhibitors of TRIM33 and methods of use TRIM33, TRIM28, TRIM4 JAK2 4102/4885KIF11 2061/4885MKNK1 739/4885
US-20200255422-A1 INHIBITORS OF TRIM33 AND METHODS OF USE TRIM33, TRIM28, TRIM4 JAK2 4102/4885KIF11 2061/4885MKNK1 739/4885
US-20240067641-A1 INHIBITORS OF TRIM33 AND METHODS OF USE TRIM33, TRIM28, TRIM4 JAK2 4102/4885KIF11 2061/4885MKNK1 739/4885

“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.