SCHEMBL160745

SCHEMBL160745

NC(=O)c1ccc2nccn2c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.51
KEAP1 Q14145 1/20 0.50
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
KMT2A Q03164 1/20 0.47
NAMPT P43490 10/20 0.47
MCHR1 Q99705 1/20 0.47
HDAC1 Q13547 1/20 0.46
DYRK1A Q13627 2/20 0.46
S1PR3 Q99500 1/20 0.44
ESR1 P03372 1/20 0.44
SYK P43405 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
Hydrochloric Acid SCHEMBL30259053 0.98 MAOB (0.50) MAOBKEAP1MEN1CYP1A2KMT2A
Formic Acid SCHEMBL31105273 0.94 MAOB (0.47) MAOBKEAP1MEN1CYP1A2KMT2A
Trifluoroacetic Acid SCHEMBL29651920 0.89 MCHR1 (0.49) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL173528 0.84 MAOB (0.52) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL27979408 0.83 KEAP1 (0.56) MAOBKEAP1NAMPTHDAC1CYP2C9
Hydrochloric Acid SCHEMBL15232009 0.82 MAOB (0.51) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL15038280 0.82 MAOB (0.55) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL4402398 0.82 KEAP1 (0.50) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL12327197 0.82 MAOB (0.51) MAOBKEAP1MEN1CYP1A2KMT2A
SCHEMBL3492329 0.81 MAOB (0.58) MAOBKEAP1NAMPTMCHR1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP claimed
EP-3856735-B1 FUSED BICYCLIC HETEROCYCLES AS THERAPEUTIC AGENTS UNIV NEW YORK (US) 2023-09-06 EP claimed
EP-3472149-B1 HETEROCYCLIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2023-08-30 EP claimed
EP-3172205-A1 4,5-DIHYDROISOXAZOLE DERIVATIVES AS NAMPT INHIBITORS Aurigene Discovery Technologies Limited (IN) 2017-05-31 EP claimed
WO-2016012958-A1 4,5-DIHYDROISOXAZOLE DERIVATIVES AS NAMPT INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-01-28 WO claimed
WO-2014111871-A1 4,5-DIHYDROISOXAZOLE DERIVATIVES AS NAMPT INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-07-24 WO claimed
EP-2611804-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT Forma TM, LLC. (US) 2013-07-10 EP claimed
WO-2012031197-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT FORMA THERAPEUTICS, INC. (US) 2012-03-08 WO claimed
WO-2002060440-A1 NOVEL FORMS OF 2,3-DIMETHYL-8-(2-ETHYL-6-METHYLBENZYLAMINO)-IMIDAZO (1,2-A)PYRIDINE-6-CARBOXAMIDE ASTRAZENECA AB (SE) 2002-08-08 WO claimed
US-12336981-B2 Compounds and compositions for the inhibition of NAMPT VALO HEALTH, INC. (US) 2025-06-24 US disclosed
US-20250179013-A1 INHIBITORS OF RNA HELICASE DHX9 AND USES THEREOF ACCENT THERAPEUTICS, INC. 2025-06-05 US disclosed
WO-2025076501-A1 HIGH THROUGHPUT PARALLEL SYNTHESIS OF SMALL MOLECULE DEGRADERS THE SCRIPPS RESEARCH INSTITUTE (US) 2025-04-10 WO disclosed
CN-119095839-A Quinoline derivatives as modulators and related products of Mas-associated G protein receptor X2 伊赛恩特制药公司 2024-12-06 CN disclosed
CN-118786117-A Heterocyclic amides and methods of use thereof 亚根达医疗公司 2024-10-15 CN disclosed
US-4962100-A 3-Condensed imidazolium-cephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-10-09 US disclosed
US-4864022-A 3-Condensed imidazolium-cephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-09-05 US disclosed
US-4788185-A Cephalosporin compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-29 US disclosed
EP-0203271-A2 Antibacterial compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1986-12-03 EP disclosed
WO-1986005183-A1 ANTIBACTERIAL COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-09-12 WO disclosed
EP-0160252-A2 Antibacterial compounds Takeda Chemical Industries, Ltd. (JP) 1985-11-06 EP 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 (2 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-20250179013-A1 INHIBITORS OF RNA HELICASE DHX9 AND USES THEREOF DHX9, DHX29, DDX39B MAOB 3798/4885KEAP1 657/4885MEN1 3047/4885
US-12336981-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NNT MAOB 105/4885KEAP1 278/4885MEN1 491/4885

“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.