SCHEMBL2048722

SCHEMBL2048722

c1ccc(Oc2cccnn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.52
LTA4H P09960 3/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
HAO1 Q9UJM8 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
LOXL2 Q9Y4K0 2/20 0.41
LOX P28300 1/20 0.40
GLA P06280 1/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TLR8 Q9NR97 1/20 0.38

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
SCHEMBL30310050 1.00 BCAT2 (0.52) BCAT2LTA4HTSHRSMN1; SMN2NPC1
SCHEMBL30310049 1.00 BCAT2 (0.52) BCAT2LTA4HTSHRSMN1; SMN2NPC1
SCHEMBL28775655 0.84 GOT1 (0.41) BCAT2TSHRSMN1; SMN2NPC1RAB9A
SCHEMBL29415402 0.82 KMT2A (0.45) ALDH1A1HTTMEN1KMT2AL3MBTL1
SCHEMBL4797475 0.82 MEN1 (0.39) BCAT2MEN1KMT2ABACE1
SCHEMBL5687024 0.82 MEN1 (0.48) BCAT2LTA4HMEN1KMT2ABACE1
SCHEMBL4797479 0.82 MEN1 (0.50) BCAT2TSHRSMN1; SMN2NPC1RAB9A
SCHEMBL20240603 0.82 MEN1 (0.35) BCAT2MEN1KMT2ABACE1
SCHEMBL2750461 0.82 KMT2A (0.64) TSHRSMN1; SMN2NPC1RAB9ACYP2C9
Pyridazine SCHEMBL27846345 0.79 GOT1 (0.38) TSHRSMN1; SMN2NPC1RAB9AMEN1

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
WO-2024241320-A1 CHLOROTOLURON HERBICIDAL MIXTURES ADAMA AGAN LTD. (IL) 2024-11-28 WO claimed
CN-116239458-A Aryl glyceraldehyde derivative and application thereof in heart failure resistance 华东理工大学 2023-06-09 CN claimed
CN-115873251-A Modified maleimide prepolymer, preparation method thereof and resin composition 苏州生益科技有限公司 2023-03-31 CN claimed
WO-2019173131-A1 CATALYST SYSTEMS COMPRISING ACTIVATOR, POLYMERIZATION PROCESSES USING SAME, AND PRODUCTS MADE THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-09-12 WO claimed
US-20190275506-A1 Catalyst Systems Comprising Activator, Polymerization Processes Using Same, and Products Made Therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2019-09-12 US claimed
JP-55007250-A None JP disclosed
JP-53147083-A None JP disclosed
JP-61247735-A None JP disclosed
WO-2026090571-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. (US) 2026-04-30 WO disclosed
US-20260116873-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE INC (US) 2026-04-30 US disclosed
US-20260116872-A1 THIOPHENE BASED APYRASE INHIBITORS TEXAS CROP SCIENCE INC (US) 2026-04-30 US disclosed
WO-2026090564-A2 THIOPHENE BASED APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. (US) 2026-04-30 WO disclosed
US-5559080-A 3-phenoxypyridazines, herbicidal compositions and uses thereof MONSANTO COMPANY (US) 1996-09-24 US disclosed
US-5559080-A 3-phenoxypyridazines, herbicidal compositions and uses thereof MONSANTO COMPANY (US) 1996-09-24 US disclosed
US-5536701-A 3-pyrazolyloxypyridazines, herbicidal compositions and uses thereof MONSANTO COMPANY (US) 1996-07-16 US disclosed
US-5484761-A PRE OR POSTEMERGENT HERBICIDES MONSANTO COMPANY (US) 1996-01-16 US disclosed
JP-S61247735-A POLYETHER-AMIDE-IMIDE AND ITS PRODUCTION IDEMITSU KOSAN CO LTD 1986-11-05 JP disclosed
JP-S557250-A AGRICULTURAL AND HORTICULTURAL FUNGICIDE SANKYO CO LTD 1980-01-19 JP disclosed
JP-S53147083-A PREPARATION OF PHENOXYPYRIDAZINE DERIVATIVES SANKYO CO LTD 1978-12-21 JP disclosed
US-3963477-A Herbicidal mixtures of S-halobenzyl-N,N-dialkylthiolcarbamates and 3-lower alkyl-2,1,3-benzothiadiazinone-(4)-2,2-dioxides and salts thereof BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-06-15 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 (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-20260116873-A1 APYRASE INHIBITORS APEH, AP3M1, SRR BCAT2 1163/4885LTA4H 1495/4885TSHR 471/4885
US-20260116872-A1 THIOPHENE BASED APYRASE INHIBITORS SRR, APEH, OSR1 BCAT2 2475/4885LTA4H 3008/4885TSHR 136/4885

“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.