SCHEMBL2324632

SCHEMBL2324632

C(=NOCCCN1CCCCC1)c1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.54
CHRNB2 P17787 2/20 0.48
CHRNA4 P43681 2/20 0.48
HRH3 Q9Y5N1 6/20 0.43
HRH1 P35367 2/20 0.43
ALDH1A1 P00352 1/20 0.42
LTA4H P09960 1/20 0.42
CHRNA7 P36544 1/20 0.42
HRH2 P25021 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MET P08581 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
OPRK1 P41145 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL30420765 1.00 TAAR1 (0.54) TAAR1CHRNB2CHRNA4HRH3HRH1
Hydrochloric Acid SCHEMBL6549764 0.82 HRH1 (0.44) TAAR1CHRNB2CHRNA4HRH3HRH1
SCHEMBL6548755 0.81 HRH1 (0.45) CHRNB2CHRNA4HRH3HRH1LTA4H
SCHEMBL6548752 0.81 HRH1 (0.45) CHRNB2CHRNA4HRH3HRH1LTA4H
SCHEMBL28355080 0.77 TAAR1 (0.45) TAAR1SMN1; SMN2KDM4E
SCHEMBL1094428 0.77 HDAC3 (0.41) TAAR1CHRNB2CHRNA4HRH3LTA4H
SCHEMBL6549844 0.76 HRH2 (0.54) CHRNB2CHRNA4HRH3HRH1CHRNA7
SCHEMBL6549840 0.76 HRH2 (0.54) CHRNB2CHRNA4HRH3HRH1CHRNA7
Fumaric Acid SCHEMBL7680912 0.76 HRH1 (0.45) HRH3HRH1ALDH1A1CHRNA7HRH2
Maleic Acid SCHEMBL7680908 0.76 HRH1 (0.45) HRH3HRH1ALDH1A1CHRNA7HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145795-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-05-11 US disclosed
WO-2023076352-A2 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-05-04 WO disclosed
US-20110224200-A1 THERAPEUTIC AGENT FOR CHORIORETINAL DEGENERATIVE DISEASE CONTAINING PYRIDINE-3-CARBALDEHYDE 0-(PIPERIDIN-1-YL-PROPYL)-OXIME DERIVATIVE AS ACTIVE INGREDIENT SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-15 US disclosed
EP-2356988-A1 THERAPEUTIC AGENT FOR CHORIORETINAL DEGENERATIVE DISEASES COMPRISING PYRIDINE-3-CARBALDEHYDE O-(PIPERIDIN-1-YL-PROPYL)-OXIME DERIVATIVE AS ACTIVE INGREDIENT Santen Pharmaceutical Co., Ltd (JP) 2011-08-17 EP 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-20230145795-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF ADAR, TRDMT1, RNMT TAAR1 4518/4885CHRNB2 909/4885CHRNA4 1341/4885
US-20110224200-A1 THERAPEUTIC AGENT FOR CHORIORETINAL DEGENERATIVE DISEASE CONTAINING PYRIDINE-3-CARBALDEHYDE 0-(PIPERIDIN-1-YL-PROPYL)-OXIME DERIVATIVE AS ACTIVE INGREDIENT ALDH1A2, GRK1, NR2E3 TAAR1 715/4885CHRNB2 535/4885CHRNA4 1136/4885

“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.