SCHEMBL3880995

SCHEMBL3880995

CCCCCN1CCC1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.45
ACE P12821 1/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
KCNH2 Q12809 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
GBA2 Q9HCG7 2/20 0.40
NR1I2 O75469 1/20 0.40
BCHE P06276 5/20 0.40
OPRD1 P41143 1/20 0.39
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GNAI3 P08754 2/20 0.37
GNAO1 P09471 2/20 0.37
GNAI1 P63096 2/20 0.37

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
SCHEMBL7567165 1.00 GBA1 (0.45) GBA1ACES1PR4S1PR1S1PR3
SCHEMBL7132021 1.00 GBA1 (0.45) GBA1ACES1PR4S1PR1S1PR3
SCHEMBL28572785 0.98 GBA1 (0.47) GBA1ACES1PR4S1PR1S1PR3
SCHEMBL5702265 0.94 GBA2 (0.45) GBA1ACES1PR4S1PR1S1PR3
SCHEMBL5701883 0.94 GBA2 (0.45) GBA1ACES1PR4S1PR1S1PR3
SCHEMBL1381895 0.89 NR1I2 (0.50) GBA1S1PR4S1PR1S1PR3S1PR5
SCHEMBL1381896 0.89 NR1I2 (0.50) GBA1S1PR4S1PR1S1PR3S1PR5
Ammonia Solution, Strong SCHEMBL8225849 0.88 NR1I2 (0.49) GBA1S1PR4S1PR1S1PR3S1PR5
SCHEMBL4947692 0.88 SMN1; SMN2 (0.50) S1PR4S1PR1S1PR3S1PR5KCNH2
SCHEMBL7114016 0.88 SMN1; SMN2 (0.50) S1PR4S1PR1S1PR3S1PR5KCNH2

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912755-B1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRAZENECA AB (SE) 2003-06-04 EP claimed
EP-0970049-B1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRAZENECA AB (SE) 2002-06-05 EP claimed
US-6136591-A Bioresolution of N-acylazetidine-2-carboxylic acids ASTRA AB (SE) 2000-10-24 US claimed
US-6054594-A Process for the production of enantiomerically enriched N-acylazetidine-2-carboxylic acids ASTRA AB (SE) 2000-04-25 US claimed
EP-0970049-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED $i(N)-ACYLAZETIDINE-2-CARBOXYLIC ACIDS Astra Aktiebolag (SE) 2000-01-12 EP claimed
EP-0912755-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS Astra Aktiebolag (SE) 1999-05-06 EP claimed
WO-1998002568-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO claimed
WO-1998002417-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO claimed
JP-2009108079-A PREPARATION METHOD OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACID ASTRAZENECA AB 2009-05-21 JP disclosed
JP-2009022270-A BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACID ASTRAZENECA AB 2009-02-05 JP disclosed
EP-0974670-B1 Process for producing optically active N-substituted azetidine-2-carboxylic acid compound SUMITOMO CHEMICAL CO (JP) 2006-09-13 EP disclosed
US-20040171849-A1 Process for producing optically active azetidine-2-carboxylic acid KANEKA CORPORATION (JP) 2004-09-02 US disclosed
EP-1415985-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AZETIDINE-2-CARBOXYLIC ACID KANEKA CORPORATION (JP) 2004-05-06 EP disclosed
EP-1170287-B1 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE N-SUBSTITUTED AZETIDINE-2-CARBOXYLIC ACIDS KANEKA CORP (JP) 2003-12-03 EP disclosed
EP-0912755-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS Astra Aktiebolag (SE) 1999-05-06 EP disclosed
WO-1999004015-A1 MICROORGANISM AND ESTERASE OBTAINED THEREFROM CHIROTECH TECHNOLOGY LIMITED (GB) 1999-01-28 WO disclosed
WO-1998002417-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO disclosed
WO-1998002417-A1 PROCESS FOR THE PRODUCTION OF ENANTIOMERICALLY ENRICHED N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO disclosed
WO-1998002568-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 WO disclosed
WO-1998002568-A1 THE BIORESOLUTION OF N-ACYLAZETIDINE-2-CARBOXYLIC ACIDS ASTRA AKTIEBOLAG (SE) 1998-01-22 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-20040171849-A1 Process for producing optically active azetidine-2-carboxylic acid HBB, ADCY2, ADCY9 GBA1 436/4885ACE 1397/4885S1PR4 4321/4885

“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.