SCHEMBL5368634

SCHEMBL5368634

Cc1cn(C)cc1C=C1C(=O)Nc2c(Br)cc(Br)cc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.38
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
NTSR1 P30989 2/20 0.38
XBP1 P17861 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH2 P05091 1/20 0.38
ALDH3A1 P30838 1/20 0.38
RET P07949 1/20 0.37
MEN1 O00255 4/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FLT3 P36888 1/20 0.34
PLK4 O00444 2/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
MDM2 Q00987 1/20 0.32
NTRK1 P04629 1/20 0.32
MAP3K5 Q99683 1/20 0.32

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
SCHEMBL7133302 0.80 MAPT (0.32) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL7139735 0.80 KMT2A (0.55) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL7138980 0.79 KMT2A (0.48) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL7133859 0.79 KMT2A (0.48) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL5358279 0.76 KMT2A (0.38) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL7139568 0.75 NTRK1 (0.63) KMT2AMAPTALDH1A1MAPK1RET
SCHEMBL5368618 0.75 ERN1 (0.46) KMT2AMAPTMAPK1MEN1TDP1
SCHEMBL5365774 0.75 IKBKB (0.41) KMT2AMAPTALDH1A1NTSR1XBP1
SCHEMBL5362076 0.74 LRRK2 (0.52) KMT2AMAPTALDH1A1MAPK1MEN1
SCHEMBL5368595 0.74 RET (0.65) KMT2AMAPTMAPK1RETMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-20050197382-A1 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. 2005-09-08 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-20050197382-A1 Indolinone combinatorial libraries and related products and methods for the treatment of disease FRK, PTK2, DSTYK KMT2A 4060/4885MAPT 3048/4885ALDH1A1 2044/4885

“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.