SCHEMBL2532414

SCHEMBL2532414

O=C(O)C1(NI)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
CYP1A2 P05177 2/20 0.37
USP2 O75604 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 2/20 0.33
AKR1C1 Q04828 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
FFAR3 O14843 1/20 0.31
MAPT P10636 1/20 0.31
HDAC4 P56524 1/20 0.31
FAAH O00519 1/20 0.30

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
SCHEMBL2533761 1.00 CYP2C19 (0.38) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL373016 0.97 CYP1A2 (0.38) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL8330866 0.92
SCHEMBL2533461 0.87
SCHEMBL59600 0.79 CYP2C19 (0.41) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL7824150 0.77 CYP2C19 (0.39) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL2837316 0.77 KMT2A (0.40) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL14253223 0.75 CYP2C19 (0.38) CYP2C19CYP1A2USP2SMN1; SMN2HTT
SCHEMBL10808711 0.75 ALDH1A1 (0.40) CYP2C19CYP1A2USP2SMN1; SMN2HTT
Bromide SCHEMBL16057314 0.75 KMT2A (0.39) CYP2C19CYP1A2USP2SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117957016-A SARS-COV-2 and influenza combined vaccine 斯皮科纳股份有限公司 2024-04-30 CN disclosed
US-20230265128-A1 STABILISED VIRAL FUSION PROTEINS OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2023-08-24 US disclosed
US-20230256085-A1 COMBINATION VACCINE SPICONA INC. 2023-08-17 US disclosed
US-20230227807-A1 METHOD FOR IDENTIFYING RNA BINDING PROTEIN BINDING SITES ON RNA THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) 2023-07-20 US disclosed
EP-2389190-A2 FGF21 DERIVATIVES WITH ALBUMIN BINDER A-B-C-D-E- AND THEIR USE Novo Nordisk A/S (DK) 2011-11-30 EP disclosed
US-20110253729-A1 CONTAINER FOR DISPENSING FLUID RING THOMAS J 2011-10-20 US disclosed
WO-2010084169-A2 FGF21 DERIVATIVES WITH ALBUMIN BINDER A-B-C-D-E- AND THEIR USE NOVO NORDISK A/S (DK) 2010-07-29 WO 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-20230256085-A1 COMBINATION VACCINE ACE2, ACE, NEU2 CYP2C19 2108/4885CYP1A2 2949/4885USP2 656/4885

“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.