SCHEMBL19853046

SCHEMBL19853046

CCOC(=O)C(CC(=O)CC)C[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 5/20 0.41
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
KMT2A Q03164 1/20 0.37
SOAT1 P35610 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CPB2 Q96IY4 2/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL19838298 0.84 CPA1 (0.42) CPA1MEN1NPC1KMT2ACPB2
SCHEMBL19852996 0.80 CPA1 (0.50) CPA1MEN1NPC1KMT2AALDH1A1
SCHEMBL28852382 0.76 HDAC1 (0.41) MEN1NPC1KMT2ASOAT1CPB2
SCHEMBL1410076 0.75 CPA1 (0.49) CPA1MEN1NPC1KMT2AL3MBTL1
SCHEMBL19853042 0.75 CPA1 (0.43) CPA1MEN1NPC1KMT2ACPB2
SCHEMBL18764229 0.75 CPA1 (0.49) CPA1MEN1NPC1KMT2AL3MBTL1
SCHEMBL8582165 0.75 CPA1 (0.42) CPA1MEN1KMT2ASOAT1L3MBTL1
SCHEMBL28677669 0.73 CPA1 (0.41) CPA1SOAT1L3MBTL1ALDH1A1MAPT
SCHEMBL21077520 0.72 CPA1 (0.39) CPA1ALDH1A1
SCHEMBL21258133 0.72 CPA1 (0.44) CPA1SOAT1L3MBTL1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190169125-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2019-06-06 US claimed
WO-2018025295-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2018-02-08 WO claimed
US-20210276954-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-09-09 US disclosed
US-20210276954-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-09-09 US disclosed
US-10988446-B2 Concise process for preparing 3-pyrrolidine carboxylic acid derivatives OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-04-27 US disclosed
US-10988446-B2 Concise process for preparing 3-pyrrolidine carboxylic acid derivatives OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-04-27 US disclosed
US-20190169125-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2019-06-06 US disclosed
US-20190169125-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2019-06-06 US disclosed
WO-2018025295-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2018-02-08 WO disclosed
WO-2018025295-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2018-02-08 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 (3 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-20210276954-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES HPD, ALDH18A1, PGA5 CPA1 404/4885MEN1 3588/4885NPC1 3580/4885
US-20190169125-A1 CONCISE PROCESS FOR PREPARING 3-PYRROLIDINE CARBOXYLIC ACID DERIVATIVES HPD, ALDH18A1, PGA5 CPA1 404/4885MEN1 3588/4885NPC1 3580/4885
US-10988446-B2 Concise process for preparing 3-pyrrolidine carboxylic acid derivatives HPD, ALDH18A1, PGA5 CPA1 404/4885MEN1 3588/4885NPC1 3580/4885

“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.