SCHEMBL17149653

SCHEMBL17149653

CC(NC(=O)c1cc2cc(F)ccc2[nH]1)c1cccc(F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.53
SMYD3 Q9H7B4 1/20 0.53
KDM4E B2RXH2 1/20 0.51
PDPK1 O15530 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
NFKB1 P19838 1/20 0.51
APEX1 P27695 1/20 0.51
CYP2C19 P33261 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RCE1 Q9Y256 1/20 0.51
FLT3 P36888 4/20 0.50
MLLT1 Q03111 1/20 0.50
AR P10275 1/20 0.49
NPC1 O15118 1/20 0.47

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
SCHEMBL17149652 0.92 RAB9A (0.56) PYGLSMYD3KDM4EALDH1A1HPGD
SCHEMBL17149666 0.91 PYGL (0.60) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL17149890 0.91 PYGL (0.60) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL17149882 0.91 PYGL (0.60) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL2735828 0.90 FLT3 (0.59) SMYD3KDM4EALDH1A1MEN1KMT2A
SCHEMBL17149685 0.85 IDO1 (0.55) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL17149891 0.84 KMT2A (0.51) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL13761503 0.83 MLLT1 (0.61) PYGLSMYD3KDM4EPDPK1ALDH1A1
SCHEMBL17149921 0.81 AR (0.61) PYGLKDM4ECYP2C19MEN1KMT2A
SCHEMBL17149917 0.81 AR (0.61) PYGLKDM4ECYP2C19MEN1KMT2A

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 PYGL 60/4885SMYD3 1984/4885KDM4E 556/4885
US-10167257-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 PYGL 63/4885SMYD3 1961/4885KDM4E 570/4885
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 PYGL 63/4885SMYD3 1961/4885KDM4E 570/4885
US-20190084933-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 PYGL 65/4885SMYD3 2111/4885KDM4E 537/4885

“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.