SCHEMBL31707401

SCHEMBL31707401

CN1CC2(CCNCC2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 5/20 0.50
SIGMAR1 Q99720 5/20 0.50
AKT1 P31749 6/20 0.47
NOTUM Q6P988 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
P2RY1 P47900 1/20 0.40
TSHR P16473 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39

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
SCHEMBL1587507 1.00 SLC18A3 (0.50) SLC18A3SIGMAR1AKT1NOTUMHDAC1
Hydrochloric Acid SCHEMBL28998916 0.98 SLC18A3 (0.49) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL4270092 0.90 SLC18A3 (0.45) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL19337171 0.87 NOTUM (0.58) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL12315997 0.86 SLC18A3 (0.45) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL9917019 0.83 NOTUM (0.60) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL29350111 0.83 SLC18A3 (0.57) SLC18A3SIGMAR1NOTUMHDAC1HDAC8
SCHEMBL31573145 0.83 NOTUM (0.60) SLC18A3SIGMAR1AKT1NOTUMHDAC1
SCHEMBL29948572 0.81 SLC18A3 (0.56) SLC18A3SIGMAR1NOTUMHDAC1HDAC8
SCHEMBL14685818 0.81 SLC18A3 (0.56) SLC18A3SIGMAR1NOTUMHDAC1HDAC8

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-12448388-B2 PRMT5 inhibitors and uses thereof GILEAD SCIENCES, INC. (US) 2025-10-21 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-12448388-B2 PRMT5 inhibitors and uses thereof PRMT5, PRMT1, PRMT9 SLC18A3 3296/4885SIGMAR1 4792/4885AKT1 694/4885

“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.