SCHEMBL4716462

SCHEMBL4716462

O=C(O)CCc1cc(F)c(F)cc1F

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.52
FFAR1 O14842 15/20 0.51
FFAR4 Q5NUL3 13/20 0.51
POLB P06746 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
TSPO P30536 1/20 0.40
DRD3 P35462 1/20 0.40
PKM P14618 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
SCHEMBL536350 0.88 F13A1 (0.50) FFAR1FFAR4HDAC1HDAC8
SCHEMBL30427892 0.88 F13A1 (0.50) FFAR1FFAR4HDAC1HDAC8
SCHEMBL22668008 0.86 FFAR1 (0.47) NPSR1FFAR1FFAR4POLBPKM
SCHEMBL26633682 0.86 F13A1 (0.58) NPSR1FFAR1FFAR4HDAC1HDAC8
SCHEMBL20185961 0.84 HDAC1 (0.44) NPSR1FFAR1FFAR4HDAC1HDAC8
SCHEMBL25213812 0.84 FFAR1 (0.50) NPSR1FFAR1FFAR4POLBPKM
SCHEMBL15632913 0.84 FFAR1 (0.46) NPSR1FFAR1FFAR4POLB
SCHEMBL27898388 0.84 MMP12 (0.42) NPSR1FFAR1FFAR4HDAC1HDAC8
SCHEMBL28259923 0.84 F13A1 (0.61) HDAC1HDAC8
SCHEMBL18602041 0.83 FFAR1 (0.49) NPSR1FFAR1FFAR4POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12404265-B2 Substituted pyridine derivatives as SARM1 inhibitors NURA BIO, INC. (US) 2025-09-02 US disclosed
US-11970481-B1 Substituted pyridine derivatives as SARM1 inhibitors NURA BIO, INC. (US) 2024-04-30 US disclosed
US-20240116901-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS NURA BIO, INC. 2024-04-11 US disclosed
US-20230339913-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS NURA BIO, INC. 2023-10-26 US disclosed
US-20230339913-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS NURA BIO, INC. 2023-10-26 US disclosed
EP-4192828-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS Nura Bio, Inc. (US) 2023-06-14 EP disclosed
CN-110577542-A Preparation method of sitagliptin 南京奇可药业有限公司 2019-12-17 CN disclosed
US-8912327-B2 Process for the production of sitagliptin CHEMO IBERICA, S.A. (ES) 2014-12-16 US disclosed
US-8912327-B2 Process for the production of sitagliptin CHEMO IBERICA, S.A. (ES) 2014-12-16 US disclosed
US-8912327-B2 Process for the production of sitagliptin CHEMO IBERICA, S.A. (ES) 2014-12-16 US disclosed
US-20140081026-A1 PROCESS FOR THE PRODUCTION OF SITAGLIPTIN CHEMO IBERICA S.A. (ES) 2014-03-20 US disclosed
EP-2705026-A1 PROCESS FOR THE PRODUCTION OF SITAGLIPTIN Chemo Iberica, S.A. (ES) 2014-03-12 EP disclosed
WO-2012150328-A1 PROCESS FOR THE PRODUCTION OF SITAGLIPTIN CHEMO IBERICA, S.A. (ES) 2012-11-08 WO disclosed
WO-2012150328-A1 PROCESS FOR THE PRODUCTION OF SITAGLIPTIN CHEMO IBERICA, S.A. (ES) 2012-11-08 WO disclosed
EP-1337517-B1 PYRIMIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 2008-11-26 EP disclosed
US-7244722-B2 Amino-substituted 1H-pyrazin-2-ones and 1H-quinoxalin-2-ones BIOVITRUM AB (SE) 2007-07-17 US disclosed
EP-1534391-B1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS BIOVITRUM AB (SE) 2007-02-14 EP disclosed
EP-1534391-A1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS Biovitrum AB (SE) 2005-06-01 EP disclosed
US-20040063693-A1 Compounds BIOVITRUM AB (SE) 2004-04-01 US disclosed
WO-2004009586-A1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS BIOVITRUM AB (SE) 2004-01-29 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 (6 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-12404265-B2 Substituted pyridine derivatives as SARM1 inhibitors SARM1, SARNP, ADRM1 NPSR1 4397/4885FFAR1 4246/4885FFAR4 4580/4885
US-11970481-B1 Substituted pyridine derivatives as SARM1 inhibitors SARM1, SARNP, ADRM1 NPSR1 4397/4885FFAR1 4246/4885FFAR4 4580/4885
US-20230339913-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS SARM1, SARNP, ADRM1 NPSR1 4397/4885FFAR1 4246/4885FFAR4 4580/4885
US-20040063693-A1 Compounds HTR1A, HTR1B, HTR2C NPSR1 32/4885FFAR1 146/4885FFAR4 197/4885
US-20240116901-A1 SUBSTITUTED PYRIDINE DERIVATIVES AS SARM1 INHIBITORS SARM1, SARNP, ADRM1 NPSR1 4397/4885FFAR1 4246/4885FFAR4 4580/4885
US-20140081026-A1 PROCESS FOR THE PRODUCTION OF SITAGLIPTIN DPP4, DPP7, DPP3 NPSR1 2925/4885FFAR1 985/4885FFAR4 240/4885

“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.