SCHEMBL4493962

SCHEMBL4493962

CN1CCN(CC(=O)Nc2cccc(N/C(=C3\C(=O)Nc4cc(C#N)ccc43)c3ccccc3)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.45
ALDH1A1 P00352 4/20 0.42
DRD4 P21917 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 2/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
ABCB1 P08183 1/20 0.41
HPGD P15428 1/20 0.41
DPP4 P27487 1/20 0.40
RAB9A P51151 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
SCHEMBL4493967 1.00 KCNA5 (0.45) KCNA5ALDH1A1DRD4SMN1; SMN2MEN1
SCHEMBL4481634 0.88 AAK1 (0.41) KCNA5ALDH1A1
SCHEMBL4481631 0.88 AAK1 (0.41) KCNA5ALDH1A1
SCHEMBL4490171 0.84 AAK1 (0.45) KCNA5
SCHEMBL4490169 0.84 AAK1 (0.45) KCNA5
SCHEMBL30979375 0.83 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL4481915 0.82 SMN1; SMN2 (0.55) KCNA5ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4493659 0.82 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL4481917 0.82 SMN1; SMN2 (0.55) KCNA5ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4493658 0.82 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA

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-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR KCNA5 2001/4885ALDH1A1 2036/4885DRD4 1051/4885

“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.