SCHEMBL16293142

SCHEMBL16293142

O=C(O)CC1(c2ccccc2)COC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
HSD11B1 P28845 5/20 0.45
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
FFAR1 O14842 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.40
EPHX2 P34913 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
LMNA P02545 2/20 0.39
IDO1 P14902 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL16539658 0.85 HSD11B1 (0.46) TSHRHSD11B1FFAR1L3MBTL1ALDH1A1
SCHEMBL20788461 0.84 HSD11B1 (0.45) TSHRHSD11B1KMT2AFFAR1L3MBTL1
SCHEMBL15577265 0.83 TSHR (0.54) TSHRHSD11B1KMT2AL3MBTL1ALDH1A1
SCHEMBL17817788 0.83 TSHR (0.40) TSHRHSD11B1FFAR1IDO1
SCHEMBL24660952 0.82 TSHR (0.40) TSHRHSD11B1PKMKMT2AFFAR1
SCHEMBL2674910 0.82 ALDH1A1 (0.41) TSHRHSD11B1PKMKMT2AFFAR1
SCHEMBL1361875 0.82 TSHR (0.58) TSHRHSD11B1PKMKMT2AL3MBTL1
SCHEMBL15140512 0.82 NR3C1 (0.46) TSHRHSD11B1KMT2AFFAR1L3MBTL1
SCHEMBL15577224 0.81 TSHR (0.63) TSHRHSD11B1L3MBTL1ALDH1A1LMNA
SCHEMBL29112417 0.81 TSHR (0.39) TSHRHSD11B1PKMKMT2AFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766352-B1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIV HEALTH NETWORK UHN (CA) 2018-06-06 EP disclosed
US-9580390-B2 Indazole compounds as kinase inhibitors and method of treating cancer with same UNIVERSITY HEALTH NETWORK (CA) 2017-02-28 US disclosed
US-20140371202-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2014-12-18 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 (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-20140371202-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME PLK4, PLK2, PLK3 TSHR 2912/4885HSD11B1 982/4885PKM 467/4885

“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.