SCHEMBL19658643

SCHEMBL19658643

CC(=O)NC1CCN(c2ncc(C)cn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.50
SKP1 P63208 1/20 0.50
SKP2 Q13309 1/20 0.50
SMPD3 Q9NY59 1/20 0.46
SMO Q99835 1/20 0.46
AKT1 P31749 1/20 0.45
TSHR P16473 2/20 0.45
GPR119 Q8TDV5 1/20 0.45
PIK3CA P42336 1/20 0.45
MTOR P42345 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP11B2 P19099 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ACACB O00763 1/20 0.42
ACKR3 P25106 1/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL19658659 0.87 CKS1B (0.49) CKS1BSKP1SKP2SMPD3SMO
SCHEMBL19658461 0.84 MEN1 (0.59) CKS1BSKP1SKP2SMOGPR119
SCHEMBL19652124 0.84 MCHR1 (0.43) TSHRGPR119ALDH1A1KDM4EHPGD
SCHEMBL28982919 0.83 ACACB (0.48) CKS1BSKP1SKP2SMPD3ALDH1A1
SCHEMBL19658656 0.83 LRRK2 (0.50) CKS1BSKP1SKP2SMPD3AKT1
SCHEMBL20152894 0.80 KDM4E (0.50) GPR119ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL12525108 0.79 GPR119 (0.47) SMOGPR119
SCHEMBL12490730 0.79 OPRK1 (0.52) SMOGPR119
SCHEMBL19658647 0.78 KDM4E (0.70) CKS1BSKP1SKP2TSHRALDH1A1
SCHEMBL21551131 0.77 MEN1 (0.45) CKS1BSKP1SKP2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 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-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 CKS1B 239/4885SKP1 2240/4885SKP2 2256/4885

“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.