SCHEMBL31730656

SCHEMBL31730656

CC(C)(C)OC(=O)NC1(C(=O)O)CCc2cc(Br)ccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.41
NPC1 O15118 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AAK1 Q2M2I8 10/20 0.35
GHSR Q92847 1/20 0.35
FPR3 P25089 4/20 0.34
FPR2 P25090 4/20 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
SCHEMBL17040901 0.83 BACE1 (0.43) BACE1NPC1RECQLRAB9ASMN1; SMN2
SCHEMBL4837190 0.83 GHSR (0.43) BACE1NPC1RAB9AGHSR
SCHEMBL306307 0.83 GHSR (0.43) BACE1NPC1RAB9AGHSR
SCHEMBL18614341 0.83 GHSR (0.43) BACE1NPC1RAB9AGHSR
SCHEMBL4835508 0.81 DPP8 (0.39) BACE1GHSR
SCHEMBL4835493 0.81 DPP8 (0.39) BACE1GHSR
SCHEMBL17605455 0.79 KDM4E (0.35) BACE1RECQL
SCHEMBL24781183 0.77 NPC1 (0.32) BACE1NPC1RECQLRAB9ASMN1; SMN2
SCHEMBL30062444 0.77 NPC1 (0.32) BACE1NPC1RECQLRAB9ASMN1; SMN2
SCHEMBL24781343 0.77 NPC1 (0.32) BACE1NPC1RECQLRAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353817-A1 INTERLUKIN-17A INHIBITORS AND USES THEREOF GILEAD SCIENCES INC (US) 2025-11-20 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-20250353817-A1 INTERLUKIN-17A INHIBITORS AND USES THEREOF IL17A, IL15, IL23R BACE1 751/4885NPC1 2168/4885RECQL 2417/4885

“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.