SCHEMBL21160746

SCHEMBL21160746

CCCCCCCN1CCC(CCCCO)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 3/20 0.50
GNAI3 P08754 2/20 0.46
GNAI1 P63096 2/20 0.46
BCHE P06276 4/20 0.46
KCNH2 Q12809 1/20 0.44
GBA1 P04062 1/20 0.44
GUSB P08236 2/20 0.44
LSS P48449 2/20 0.43
HTR1A P08908 4/20 0.43
DRD2 P14416 4/20 0.43
DRD1 P21728 4/20 0.43
DRD4 P21917 4/20 0.43
DRD5 P21918 4/20 0.43
DRD3 P35462 4/20 0.43

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
SCHEMBL28286896 0.92 GNAO1 (0.57) GNAO1GNAI3GNAI1BCHEKCNH2
Hydrochloric Acid SCHEMBL11479318 0.89 GNAO1 (0.63) GNAO1GNAI3GNAI1KCNH2DRD2
Hydrochloric Acid SCHEMBL11489213 0.89 GNAO1 (0.63) GNAO1GNAI3GNAI1KCNH2DRD2
SCHEMBL9344937 0.89 GNAO1 (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
Fluoride SCHEMBL30330478 0.87 GNAO1 (0.55) GNAO1GNAI3GNAI1BCHEKCNH2
Hydrochloric Acid SCHEMBL30330729 0.87 GNAO1 (0.59) GNAO1GNAI3GNAI1BCHEKCNH2
Fluoride SCHEMBL30330799 0.87 GNAO1 (0.55) GNAO1GNAI3GNAI1BCHEKCNH2
Hydrochloric Acid SCHEMBL30330775 0.87 GNAO1 (0.59) GNAO1GNAI3GNAI1BCHEKCNH2
Hydrochloric Acid SCHEMBL30330682 0.87 GNAO1 (0.59) GNAO1GNAI3GNAI1BCHEKCNH2
Fluoride SCHEMBL30330330 0.87 GNAO1 (0.55) GNAO1GNAI3GNAI1BCHEKCNH2

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-20210380588-A1 Novel Compounds and Uses Thereof OXFORD FINANCE LLC 2021-12-09 US disclosed
US-10329280-B2 Urea derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2019-06-25 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-20210380588-A1 Novel Compounds and Uses Thereof RB1, VEGFA, UACA GNAO1 1817/4885GNAI3 552/4885GNAI1 530/4885
US-10329280-B2 Urea derivatives and uses thereof UACA, RB1, FLT1 GNAO1 2556/4885GNAI3 949/4885GNAI1 1385/4885

“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.