SCHEMBL19652176

SCHEMBL19652176

CC(C)C(=O)N(C)CC1CCN(CC2CCCCO2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
KMT2A Q03164 4/20 0.36
DPP4 P27487 1/20 0.35
PREP P48147 1/20 0.35
FAP Q12884 1/20 0.35
MLYCD O95822 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE8B O95263 1/20 0.32
MEN1 O00255 3/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL19658605 0.86 KMT2A (0.41) CHRM4ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19658488 0.83 ACHE (0.44) DPP4PREPFAPSMN1; SMN2
SCHEMBL19658666 0.82 KMT2A (0.45) CHRM4ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19652209 0.82 ACHE (0.46) DPP4PREPFAPSMN1; SMN2
SCHEMBL16219009 0.81 MLYCD (0.42) ALDH1A1KDM4EKMT2ADPP4PREP
SCHEMBL19652172 0.80 ACHE (0.40) DPP4PREPFAPSMN1; SMN2
SCHEMBL19652175 0.80 KDM4E (0.42) KDM4EKMT2ADPP4PREPFAP
SCHEMBL19652168 0.79 KMT2A (0.39) CHRM4ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19652178 0.78 HTR4 (0.39) KDM4EKMT2ADPP4PREPFAP
SCHEMBL19652262 0.76 SMN1; SMN2 (0.42) KDM4EDPP4PREPFAPSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
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 (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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 CHRM4 2474/4885ALDH1A1 1563/4885KDM4E 320/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 CHRM4 2474/4885ALDH1A1 1563/4885KDM4E 320/4885

“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.