SCHEMBL7761685

SCHEMBL7761685

NC(=O)C1CCCC1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.56
EPHX1 P07099 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
GABRR1 P24046 1/20 0.42
GRM4 Q14833 1/20 0.42
MEN1 O00255 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
PSEN1 P49768 3/20 0.41
PSEN2 P49810 3/20 0.41
APH1B Q8WW43 3/20 0.41
NCSTN Q92542 3/20 0.41
APH1A Q96BI3 3/20 0.41
PSENEN Q9NZ42 3/20 0.41
ACE P12821 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
SCHEMBL7761680 1.00 PEPD (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL7761683 1.00 PEPD (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL8411453 1.00 PEPD (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL8411456 1.00 PEPD (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL12427230 0.97 PEPD (0.54) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL7815469 0.95 EPHX1 (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL1258973 0.95 EPHX1 (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL7818915 0.95 EPHX1 (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL7815466 0.95 EPHX1 (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1
SCHEMBL7818913 0.95 EPHX1 (0.56) PEPDEPHX1ALDH1A1LMNAGABRR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-216063207-U Cyclization reaction kettle for synthesizing 1, 2-cyclopentanedicarboximide 安徽金鼎医药股份有限公司 2022-03-18 CN disclosed
CN-112624958-A Synthetic method of medical intermediate 1, 2-cyclopentadienimide 安徽金鼎医药股份有限公司 2021-04-09 CN disclosed
EP-2882740-B1 IAP ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2017-03-01 EP disclosed
US-20010018422-A1 Dolastatin 15 derivatives BASF AKTIENGESELLSCHAFT 2001-08-30 US disclosed
EP-1093460-A1 DOLASTATIN 15 DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-04-25 EP disclosed
WO-2000002906-A1 DOLASTATIN 15 DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-01-20 WO disclosed
US-5985837-A CELL GROWTH INHIBITOR PEPTIDES; TREATING CANCER IN A MAMMAL BASF AKTIENGESELLSCHAFT (DE) 1999-11-16 US disclosed
US-5962724-A FROM THE CORRESPONDING MESODICARBOXYLIC ACID ANHYDRIDE BAYER AKTIENGESELLSCHAFT (DE) 1999-10-05 US disclosed
EP-0932598-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-08-04 EP disclosed
WO-1998016502-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed
US-4196291-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1980-04-01 US disclosed
US-4141978-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1979-02-27 US disclosed
US-4113867-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1978-09-12 US disclosed
US-4001411-A ANTHELMINTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-01-04 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-20010018422-A1 Dolastatin 15 derivatives SLCO2B1, SLCO2A1, DDOST PEPD 543/4885EPHX1 1775/4885ALDH1A1 768/4885

“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.