SCHEMBL1507158

SCHEMBL1507158

O=C1CCCN1c1ccc(F)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
LMNA P02545 2/20 0.61
USP2 O75604 1/20 0.61
HPGD P15428 6/20 0.54
AKR1C3 P42330 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
TP53 P04637 2/20 0.52
GLA P06280 1/20 0.52
PKM P14618 1/20 0.52
MAPK1 P28482 2/20 0.52
KDM4E B2RXH2 1/20 0.52
TSHR P16473 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL29930171 1.00 ALDH1A1 (0.62) ALDH1A1LMNAUSP2HPGDAKR1C3
SCHEMBL3666589 0.94 LMNA (0.59) ALDH1A1LMNAUSP2HPGDAKR1C3
SCHEMBL2728631 0.92 LMNA (0.58) ALDH1A1LMNAUSP2HPGDAKR1C3
SCHEMBL11142367 0.89 ALDH1A1 (0.74) ALDH1A1HPGDAKR1C3SMN1; SMN2NPC1
SCHEMBL18805067 0.88 RAB9A (0.51) ALDH1A1LMNAUSP2AKR1C3SMN1; SMN2
SCHEMBL12615119 0.88 RAB9A (0.51) ALDH1A1LMNAUSP2AKR1C3SMN1; SMN2
SCHEMBL78465 0.82 ALDH1A1 (0.65) ALDH1A1LMNAHPGDAKR1C3SMN1; SMN2
SCHEMBL1171241 0.80 ALDH1A1 (0.62) ALDH1A1HPGDAKR1C3SMN1; SMN2NPC1
SCHEMBL17080008 0.80 LMNA (0.50) ALDH1A1LMNAUSP2HPGDAKR1C3
SCHEMBL19356857 0.80 ALDH1A1 (0.62) ALDH1A1HPGDAKR1C3SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102239146-A Novel compounds as calcium channel blockers ABBOTT LAB 2011-11-09 CN claimed
EP-0106988-A1 Pharmacologically active lactam derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1984-05-02 EP claimed
WO-2023160638-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-08-31 WO disclosed
CN-115043768-A Method for synthesizing N-aryl pyrrolidine-2-ketone by acid-promoted ring opening of cyclopropyl 新乡市润宇新材料科技有限公司 2022-09-13 CN disclosed
EP-2300422-B1 AZETIDINES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC AG (DE) 2014-11-05 EP disclosed
CN-102015636-B Azetidines and cyclobutanes as histamine H3 receptor antagonists EVOTEC NEUROSCIENCES GMBH 2014-08-13 CN disclosed
CN-102239146-A Novel compounds as calcium channel blockers ABBOTT LAB 2011-11-09 CN disclosed
US-20110105459-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC AG (DE) 2011-05-05 US disclosed
CN-102015636-A Azetidines and cyclobutanes as histamine H3 receptor antagonists EVOTEC NEUROSCIENCES GMBH 2011-04-13 CN disclosed
EP-2300422-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS Evotec AG (DE) 2011-03-30 EP disclosed
WO-2009135842-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-11-12 WO disclosed
EP-0106988-A1 Pharmacologically active lactam derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1984-05-02 EP disclosed
US-4189495-A TREATMENT OF NERVOUS AND PSYCHOSOMATIC DISORDERS SYNTHELABO (FR) 1980-02-19 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-20110105459-A1 AZETIDINES AND CYCLOBUTANES AS HISTAMINE H3 RECEPTOR ANTAGONISTS HRH4, HRH3, HRH1 ALDH1A1 2066/4885LMNA 4520/4885USP2 1844/4885

“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.