SCHEMBL2679460

SCHEMBL2679460

N=C(N)N1CCCC1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.50
REN P00797 1/20 0.47
LMNA P02545 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 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
SCHEMBL212486 1.00 ACE (0.50) ACERENLMNACYP2C19HSD17B10
SCHEMBL9389379 1.00 ACE (0.50) ACERENLMNACYP2C19HSD17B10
SCHEMBL3260894 0.94 ACE (0.45) ACEREN
SCHEMBL17234222 0.88 ACE (0.37) ACERENLMNACYP2C19HSD17B10
SCHEMBL7827074 0.88 ACE (0.37) ACERENLMNACYP2C19HSD17B10
SCHEMBL17234226 0.88 ACE (0.37) ACERENLMNACYP2C19HSD17B10
SCHEMBL28128812 0.86 DPP4 (0.40) ACE
Hydrochloric Acid SCHEMBL28488246 0.84 SPHK1 (0.39)
SCHEMBL163319 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10
SCHEMBL30305374 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240180912-A1 COMPOSITIONS AND METHODS FOR INHIBITING CREATINE TRANSPORT AS A TREATMENT FOR CANCER INSPIRNA, INC. (US) 2024-06-06 US disclosed
WO-2023004308-A1 COMPOSITIONS AND METHODS FOR INHIBITING CREATINE TRANSPORT AS A TREATMENT FOR CANCER INSPIRNA, INC. (US) 2023-01-26 WO disclosed
EP-3950673-A1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF Inspirna, Inc. (US) 2022-02-09 EP disclosed
EP-3950673-A1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF Inspirna, Inc. (US) 2022-02-09 EP disclosed
EP-3137447-B1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF RGENIX INC (US) 2021-06-30 EP disclosed
EP-3137447-B1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF RGENIX INC (US) 2021-06-30 EP disclosed
US-10717704-B2 Inhibitors of creatine transport and uses thereof RGENIX, INC. (US) 2020-07-21 US disclosed
US-10717704-B2 Inhibitors of creatine transport and uses thereof RGENIX, INC. (US) 2020-07-21 US disclosed
US-20190315680-A1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF INSPIRNA, INC. 2019-10-17 US disclosed
US-20190315680-A1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF INSPIRNA, INC. 2019-10-17 US disclosed
US-7186754-B2 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2007-03-06 US disclosed
US-7186754-B2 Use of creatine or creatine compounds for skin preservation AVICENA GROUP, INC. (US) 2007-03-06 US disclosed
EP-0965327-B1 WRINKLING MODIFIERS KAO CORP (JP) 2005-03-16 EP disclosed
US-6706764-B2 TREATMENT OF DIABETIC AND TOXIC NEUROPATHIES, PERIPHERAL NERVOUS SYSTEM DISEASES, ALZHEIMER DISEASE, PARKINSON'S DISEASE, STROKE, HUNTINGTON'S DISEASE, AMYOTROPIC LATERAL SCLEROSIS AVICENA GROUP, INC. 2004-03-16 US disclosed
US-6436920-B1 AN ANTIWRINKLE AND ANTIAGING AGENT (COSMETIC SKIN CARE AGENT) COMPRISING A GUANIDINE DERIVATIVE KAO CORPORATION (JP) 2002-08-20 US disclosed
US-20020022611-A1 Wrinkling modifiers KAO CORPORATION (JP) 2002-02-21 US disclosed
US-6306848-B1 SKIN TREATMENT KAO CORPORATION (JP) 2001-10-23 US disclosed
EP-0965327-A1 WRINKLING MODIFIERS Kao Corporation (JP) 1999-12-22 EP disclosed
US-3972872-A BACTERICIDE, ANIMAL FEED SUPPLEMENT PFIZER INC. (US) 1976-08-03 US disclosed
US-3933797-A 6-[α-(ω-QUANIDINOALKANOYLAMIDO)ACYLAMIDO]PENICILLANIC ACIDS PFIZER INC. (US) 1976-01-20 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 (4 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-20240180912-A1 COMPOSITIONS AND METHODS FOR INHIBITING CREATINE TRANSPORT AS A TREATMENT FOR CANCER KRAS, FOLR2, SLC19A1 ACE 1330/4885REN 195/4885LMNA 3626/4885
US-10717704-B2 Inhibitors of creatine transport and uses thereof CKMT1A; CKMT1B, SLC25A1, SLC2A1 ACE 704/4885REN 263/4885LMNA 2797/4885
US-20190315680-A1 INHIBITORS OF CREATINE TRANSPORT AND USES THEREOF CKMT1A; CKMT1B, SLC25A1, SLC2A1 ACE 704/4885REN 263/4885LMNA 2797/4885
US-20020022611-A1 Wrinkling modifiers AZI2, ARG1, CUTA ACE 3621/4885REN 2500/4885LMNA 614/4885

“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.