SCHEMBL17372006

SCHEMBL17372006

CC(C)Nc1cc(CN)ccn1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 11/20 0.47
LOX P28300 4/20 0.47
LOXL3 P58215 1/20 0.47
AOC1 P19801 2/20 0.40
AOC3 Q16853 2/20 0.40
MAPK14 Q16539 2/20 0.40
MAPK10 P53779 1/20 0.40
NR3C2 P08235 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
IGF1R P08069 1/20 0.38
CFD P00746 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
SCHEMBL14270718 0.84 NOS3 (0.48) MAPK14MAPK10NR3C2HRH4IGF1R
SCHEMBL17372140 0.83 LOXL2 (0.46) LOXL2LOXLOXL3MAPK14NR3C2
SCHEMBL22388259 0.82 KDM4E (0.43) MAPK14MAPK10NR3C2HRH4IGF1R
SCHEMBL2481330 0.82 RECQL (0.47) MAPK14MAPK10NR3C2HRH4IGF1R
Hydrochloric Acid SCHEMBL31330323 0.81 MAPK14 (0.40) MAPK14MAPK10NR3C2HRH4IGF1R
SCHEMBL2643263 0.79 LOXL2 (0.52) LOXL2LOXLOXL3NR3C2
Hydrochloric Acid SCHEMBL2302210 0.78 IGF1R (0.39) MAPK14MAPK10NR3C2HRH4IGF1R
SCHEMBL18720518 0.76 LOXL2 (0.49) LOXL2LOXLOXL3NR3C2
SCHEMBL15350159 0.76 LOXL2 (0.54) LOXL2NR3C2
SCHEMBL15102638 0.76 MAPK14 (0.42) MAPK14MAPK10HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10428044-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-10-01 US disclosed
US-10428044-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-10-01 US disclosed
CN-106715415-B 3-amino-1, 5,6, 7-tetrahydro-4H-indol-4-ones 拜耳制药股份公司 2019-06-14 CN disclosed
EP-3157914-B1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma AG (DE) 2018-09-26 EP disclosed
CN-106715415-A 3-amino-1, 5,6, 7-tetrahydro-4H-indol-4-ones 拜耳制药股份公司 2017-05-24 CN disclosed
EP-3157914-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma Aktiengesellschaft (DE) 2017-04-26 EP disclosed
US-20170101391-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-13 US disclosed
US-20170101391-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-13 US disclosed
US-20170101391-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-13 US disclosed
WO-2015193339-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-12-23 WO disclosed
WO-2015193339-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-12-23 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 (2 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-20170101391-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BUB1, BUB1B, AURKB LOXL2 4391/4885LOX 3627/4885LOXL3 4493/4885
US-10428044-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones BUB1, BUB1B, AURKB LOXL2 4391/4885LOX 3627/4885LOXL3 4493/4885

“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.