SCHEMBL19652172

SCHEMBL19652172

CC(C)C(=O)N(C)CC1CCN(CC2CCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.40
DPP4 P27487 1/20 0.40
PREP P48147 1/20 0.40
FAP Q12884 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM5 P08912 1/20 0.37
ADRA2C P18825 1/20 0.37
HTR4 Q13639 4/20 0.36
CCR1 P32246 1/20 0.34

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
SCHEMBL19658488 0.97 ACHE (0.44) ACHEDPP4PREPFAPSMN1; SMN2
SCHEMBL19652209 0.96 ACHE (0.46) ACHEDPP4PREPFAPSMN1; SMN2
SCHEMBL19652175 0.87 KDM4E (0.42) DPP4PREPFAPHTR4
SCHEMBL19658671 0.83 ACHE (0.43) ACHESMN1; SMN2CHRM5ADRA2CHTR4
SCHEMBL19652262 0.83 SMN1; SMN2 (0.42) ACHEDPP4PREPFAPSMN1; SMN2
SCHEMBL19652178 0.82 HTR4 (0.39) DPP4PREPFAPHTR4
SCHEMBL22856554 0.82 PIK3CD (0.41) ACHEDPP4PREPFAPSMN1; SMN2
SCHEMBL16219074 0.81 ALOX5 (0.44) DPP4PREPFAPSMN1; SMN2
SCHEMBL22906377 0.81 EPHX1 (0.39) DPP4PREPFAPSMN1; SMN2HTR4
SCHEMBL19652176 0.80 CHRM4 (0.37) DPP4PREPFAPSMN1; 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 ACHE 2649/4885DPP4 3303/4885PREP 3639/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 ACHE 2649/4885DPP4 3303/4885PREP 3639/4885

“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.