SCHEMBL17149867

SCHEMBL17149867

CC(C)Oc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ RCE1 Q9Y256 1/20 0.56
▸ KDM4E B2RXH2 5/20 0.54
▸ MAPT P10636 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ PYGL P06737 1/20 0.51
▸ XDH P47989 1/20 0.50
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ ADRB2 P07550 1/20 0.49
▸ PDGFRB P09619 2/20 0.48
▸ PDGFRA P16234 2/20 0.48
▸ BCAT1 P54687 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ TP53 P04637 1/20 0.48

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
SCHEMBL17149703 0.91 KDM4E (0.66) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL17149840 0.87 PDGFRB (0.61) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL17149817 0.86 KDM4E (0.63) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL17149886 0.84 KMT2A (0.56) KMT2AMEN1RCE1KDM4EALDH1A1
SCHEMBL17149620 0.84 TP53 (0.64) KMT2AMEN1RCE1KDM4EALDH1A1
SCHEMBL6883379 0.83 MEN1 (0.64) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL17149629 0.83 MEN1 (0.64) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL19476075 0.83 MEN1 (0.64) KMT2AMEN1RCE1KDM4EMAPT
SCHEMBL17149864 0.83 PYGL (0.63) KMT2AMEN1PYGLNPC1RAB9A
SCHEMBL17149666 0.83 PYGL (0.60) KMT2AMEN1RCE1KDM4EALDH1A1

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
US-10858319-B2 Indole derivatives for use in medicine IOMET PHARMA LTD. (GB) 2020-12-08 — — US disclosed
US-20190084933-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2019-03-21 — — US disclosed
US-10167257-B2 Indole derivatives for use in medicine IOMET PHARMA LTD. (GB) 2019-01-01 — — US disclosed
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2017-04-20 — — US disclosed
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2017-04-20 — — US disclosed
WO-2015150097-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD (GB) 2015-10-08 — — WO 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 (4 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-10858319-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 KMT2A 1638/4885MEN1 3590/4885RCE1 1934/4885
US-10167257-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 KMT2A 1690/4885MEN1 3708/4885RCE1 1947/4885
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 KMT2A 1690/4885MEN1 3708/4885RCE1 1947/4885
US-20190084933-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 KMT2A 1615/4885MEN1 3774/4885RCE1 1942/4885

“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.

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