SCHEMBL16589337

SCHEMBL16589337

CC(C)(C)C1=CCN(C(=O)CO)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CCNT1 O60563 7/20 0.35
CDK9 P50750 7/20 0.35
GRM1 Q13255 1/20 0.33
NAMPT P43490 3/20 0.33
MAPK1 P28482 1/20 0.33
CNR1 P21554 1/20 0.33
AKR1C3 P42330 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL17886567 0.87 MEN1 (0.42) MEN1KMT2AGRM1NAMPTCNR1
SCHEMBL12139829 0.86 BLM (0.39) MEN1KMT2AGRM1NAMPT
SCHEMBL12026525 0.85 NAMPT (0.46) MEN1KMT2ANAMPTMAPK1
SCHEMBL17886565 0.85 GRM1 (0.45) MEN1KMT2AGRM1NAMPTCNR1
SCHEMBL17886557 0.84 NAMPT (0.41) MEN1KMT2ANAMPTMAPK1KDM4E
SCHEMBL17886551 0.83 NAMPT (0.44) MEN1KMT2ANAMPT
SCHEMBL19226320 0.83 NAMPT (0.43) MEN1KMT2AGRM1NAMPTCNR1
SCHEMBL12026744 0.83 NAMPT (0.47) MEN1KMT2ANAMPT
SCHEMBL14019815 0.82 KDM4E (0.46) MEN1KMT2ACCNT1CDK9GRM1
SCHEMBL17886560 0.82 JAK1 (0.39) MEN1KMT2AGRM1NAMPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10654828-B2 Indole derivatives and uses thereof NOVARTIS AG (CH) 2020-05-19 US disclosed
US-20190055219-A1 INDOLE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2019-02-21 US disclosed
US-9434695-B2 Nitrogenous heterocyclic derivatives and their application in drugs SUNSHINE LAKE PHARMA CO., LTD (CN) 2016-09-06 US disclosed
US-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-03-26 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 (3 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-20150087639-A1 Nitrogenous Heterocyclic Derivatives And Their Application In Drugs TNNC1, TNNI3, IAPP MEN1 61/4885KMT2A 2967/4885CCNT1 968/4885
US-20190055219-A1 INDOLE DERIVATIVES AND USES THEREOF MYLK2, MYOF, MUSK MEN1 2802/4885KMT2A 3973/4885CCNT1 3533/4885
US-10654828-B2 Indole derivatives and uses thereof MYLK2, MYOF, MUSK MEN1 2802/4885KMT2A 3973/4885CCNT1 3533/4885

“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.