SCHEMBL19652185

SCHEMBL19652185

CC(C)C(=O)N(C)CC1CCN(Cc2ccccc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.53
KMT2A Q03164 6/20 0.52
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 4/20 0.47
POLB P06746 3/20 0.47
MAPK1 P28482 1/20 0.46
ACHE P22303 1/20 0.46
CACNA1G O43497 1/20 0.46
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL19658384 0.88 ATM (0.55) ATMKMT2ADRD2DRD4SIGMAR1
SCHEMBL19658394 0.86 ATM (0.53) ATMKMT2ADRD2DRD4SIGMAR1
SCHEMBL19658607 0.86 CXCR4 (0.56) ATMDRD2DRD4ALDH1A1POLB
SCHEMBL19652159 0.84 ACHE (0.60) ACHE
SCHEMBL26384526 0.83 DRD2 (0.50) ATMKMT2ADRD2DRD4SIGMAR1
SCHEMBL17754011 0.82 ATM (0.63) ATMKMT2ADRD2DRD4SIGMAR1
SCHEMBL19652286 0.82 SLC6A4 (0.49) ACHE
SCHEMBL19652183 0.81 CYP2D6 (0.53) DRD2DRD4SIGMAR1ALDH1A1ACHE
SCHEMBL19652186 0.77 CXCR4 (0.50) KMT2ADRD2DRD4MEN1ALDH1A1
SCHEMBL24495004 0.77 ATM (0.63) ATMKMT2ADRD2DRD4SIGMAR1

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 ATM 1939/4885KMT2A 165/4885DRD2 2016/4885

“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.