SCHEMBL3855002

SCHEMBL3855002

O=c1ccnc(C(F)(F)F)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.42
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
PKM P14618 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
PDE3B Q13370 6/20 0.36
PDE3A Q14432 6/20 0.36
HCAR1 Q9BXC0 3/20 0.35
NPSR1 Q6W5P4 1/20 0.34
GPR84 Q9NQS5 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34

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
SCHEMBL4552842 0.80 POLB (0.36) HCAR2LMNAPOLBPDE3BPDE3A
SCHEMBL803691 0.78 GPR84 (0.41) PKMLMNAPOLBPDE3BPDE3A
SCHEMBL4552843 0.69 POLB (0.37) LMNAPOLBPDE3BPDE3AGPR84
SCHEMBL28746022 0.67 CYP1A2 (0.46) LMNAHCAR1ALDH1A1MEN1KMT2A
SCHEMBL4552845 0.67 POLB (0.38) LMNAPOLBPDE3BPDE3ANPSR1
SCHEMBL713909 0.66 POLB (0.55) LMNAPOLBNPSR1GPR84NPC1
Thiouracil SCHEMBL2856254 0.65
SCHEMBL755723 0.65
SCHEMBL11359888 0.65
SCHEMBL83773 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009158258-A1 HERBICIDAL DIHYDRO OXO SIX-MEMBERED AZINYL ISOXAZOLINES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-12-30 WO claimed
JP-5155863-A None JP disclosed
CN-120077041-A Tricyclic derivative compounds and use thereof 韩美药品株式会社 2025-05-30 CN disclosed
EP-4543881-A1 COMPOUNDS AND METHOD FOR PKMYT1 INHIBITION Engine Biosciences Pte. Ltd. (SG) 2025-04-30 EP disclosed
US-12264147-B2 Substituted carboxamides as inhibitors of WDR5 protein-protein binding Propellon Therapeutics Inc. (CA) 2025-04-01 US disclosed
WO-2024080788-A1 NOVEL TRICYCLIC DERIVATIVE COMPOUND AND USES THEREOF 한미약품 주식회사 2024-04-18 WO disclosed
WO-2023249563-A1 COMPOUNDS AND METHOD FOR PKMYT1 INHIBITION ENGINE BIOSCIENCES PTE. LTD. (SG) 2023-12-28 WO disclosed
EP-4273146-A1 TRICYCLIC COMPOUND AND USE THEREOF Nanjing Zaiming Pharmaceutical Co., Ltd. (CN) 2023-11-08 EP disclosed
US-20230219926-A1 SUBSTITUTED CARBOXAMIDES AS INHIBITORS OF WDR5 PROTEIN-PROTEIN BINDING FACIT INC. (CA) 2023-07-13 US disclosed
EP-3423451-B1 INHIBITORS OF WDR5 PROTEIN-PROTEIN BINDING PROPELLON THERAPEUTICS INC (CA) 2022-08-17 EP disclosed
JP-2009126792-A 5-SUBSTITUTED PHENYL-2-TRIFLUOROMETHYLPYRIMIDIN-6(1H)-ONE DERIVATIVE, METHOD FOR PRODUCING THE SAME AND HERBICIDE CONTAINING THE DERIVATIVE AS ACTIVE INGREDIENT SAGAMI CHEM RES CENTER 2009-06-11 JP disclosed
EP-0612317-A1 SUBSTITUTED HETEROCYCLES AS ANGIOTENSIN II ANTAGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 1994-08-31 EP disclosed
US-5256781-A Anticholesterol, antilipemic, hypotensive agents AMERICAN HOME PRODUCTS CORPORATION (US) 1993-10-26 US disclosed
US-5236925-A Hypotensive agents, treatment of congestive heart failure AMERICAN HOME PRODUCTS CORPORATION (US) 1993-08-17 US disclosed
WO-1993008170-A1 SUBSTITUTED HETEROCYCLES AS ANGIOTENSIN II ANTAGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-04-29 WO disclosed
US-5187168-A Hypotensive agents AMERICAN HOME PRODUCTS CORPORATION (US) 1993-02-16 US disclosed
EP-0396250-A1 Pyrimidinone derivatives ZENECA LIMITED (GB) 1990-11-07 EP disclosed
EP-0357201-A2 Pyridyl pyrimidinone derivatives with an insecticidal activity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-03-07 EP disclosed
EP-0338686-A2 Pyrimidinone derivatives ZENECA LIMITED (GB) 1989-10-25 EP disclosed
EP-0260621-A2 3-Aryl uracil-enol ethers and their use as herbicides F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1988-03-23 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-12264147-B2 Substituted carboxamides as inhibitors of WDR5 protein-protein binding WDR5, WDR82, WDR1 HCAR2 2443/4885KDM5A 142/4885KDM4C 957/4885
US-20230219926-A1 SUBSTITUTED CARBOXAMIDES AS INHIBITORS OF WDR5 PROTEIN-PROTEIN BINDING WDR5, WDR82, WDR1 HCAR2 2443/4885KDM5A 142/4885KDM4C 957/4885

“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.