SCHEMBL20072865

SCHEMBL20072865

CCCNN1CCC(O)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
SPHK1 Q9NYA1 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR119 Q8TDV5 1/20 0.32
DPP4 P27487 1/20 0.32
SHBG P04278 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
SCHEMBL7855660 0.80 GNAI3 (0.37) GNAI3GNAO1GNAI1
SCHEMBL7852895 0.80 CARM1 (0.42) GNAI3GNAO1GNAI1ALDH1A1
SCHEMBL7854064 0.78 GNAI3 (0.36) GNAI3GNAO1GNAI1LMNADPP4
SCHEMBL8778709 0.78 GNAI3 (0.45) GNAI3GNAO1GNAI1LMNAMEN1
SCHEMBL20000752 0.78
SCHEMBL3326166 0.74
SCHEMBL28503023 0.74
SCHEMBL1238549 0.72 GNAI3 (0.41) GNAI3GNAO1GNAI1LMNAMEN1
Water SCHEMBL27995849 0.72 GNAI3 (0.41) GNAI3GNAO1GNAI1LMNAMEN1
Ethane SCHEMBL4231792 0.70 GNAI3 (0.39) GNAI3GNAO1GNAI1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 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-10457654-B2 Therapeutic compounds and methods of use thereof NPY5R, REN, F12 GNAI3 1628/4885GNAO1 1130/4885GNAI1 1073/4885
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 GNAI3 1599/4885GNAO1 1107/4885GNAI1 1099/4885

“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.