SCHEMBL711754

SCHEMBL711754

O=C(N/N=C/c1ccccc1)c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.81
SMN1; SMN2 Q16637 5/20 0.81
NPC1 O15118 5/20 0.81
KMT2A Q03164 5/20 0.81
MEN1 O00255 4/20 0.81
CYP1A2 P05177 1/20 0.78
CYP3A4 P08684 1/20 0.78
CYP2C9 P11712 1/20 0.78
CYP2C19 P33261 1/20 0.78
ESRRG P62508 2/20 0.73
HDAC3 O15379 1/20 0.73
HDAC2 Q92769 1/20 0.73
HDAC8 Q9BY41 1/20 0.73
NCOR2 Q9Y618 1/20 0.73
ALDH1A1 P00352 2/20 0.71
MAPT P10636 2/20 0.71
PKM P14618 1/20 0.71
CA1 P00915 1/20 0.69
CA2 P00918 1/20 0.69
CA4 P22748 1/20 0.69

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
SCHEMBL711755 1.00 RAB9A (0.81) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL2830919 1.00 RAB9A (0.81) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL6720187 0.96 RAB9A (0.87) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL13568982 0.96 RAB9A (0.87) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL13568878 0.91 RAB9A (0.97) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL8767795 0.91 HDAC3 (0.72) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL12305537 0.91 RAB9A (0.73) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL20115425 0.90 RAB9A (1.00) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL8253424 0.90 RAB9A (0.77) RAB9ASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL21292680 0.90 RAB9A (1.00) RAB9ASMN1; SMN2NPC1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4580403-A2 APYRASE INHIBITORS Texas Crop Science, Inc. (US) 2025-07-09 EP claimed
CN-120166922-A Apyrase inhibitors 德州作物科学股份有限公司 2025-06-17 CN claimed
US-12031058-B2 Corrosion inhibition compositions and associated methods for inhibiting corrosion on metallic substrates THE BOEING COMPANY (US) 2024-07-09 US claimed
US-20240101510-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. 2024-03-28 US claimed
WO-2024050040-A2 APYRASE INHIBITORS TEXAS CROP SCIENCE (US) 2024-03-07 WO claimed
US-20230052367-A1 CORROSION INHIBITION COMPOSITIONS AND ASSOCIATED METHODS FOR INHIBITING CORROSION ON METALLIC SUBSTRATES THE BOEING COMPANY (US) 2023-02-16 US claimed
EP-4112776-A1 CORROSION INHIBITION COMPOSITIONS AND ASSOCIATED METHODS FOR INHIBITING CORROSION ON METALLIC SUBSTRATES The Boeing Company (US) 2023-01-04 EP claimed
US-20240352260-A1 CORROSION INHIBITION COMPOSITIONS AND ASSOCIATED METHODS FOR INHIBITING CORROSION ON METALLIC SUBSTRATES THE BOEING COMPANY (US) 2024-10-24 US disclosed
US-12031058-B2 Corrosion inhibition compositions and associated methods for inhibiting corrosion on metallic substrates THE BOEING COMPANY (US) 2024-07-09 US disclosed
US-12031058-B2 Corrosion inhibition compositions and associated methods for inhibiting corrosion on metallic substrates THE BOEING COMPANY (US) 2024-07-09 US disclosed
US-12031058-B2 Corrosion inhibition compositions and associated methods for inhibiting corrosion on metallic substrates THE BOEING COMPANY (US) 2024-07-09 US disclosed
US-20240101510-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. 2024-03-28 US disclosed
US-11813596-B2 Photocatalytic system and applications thereof Max Planck Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-11-14 US disclosed
US-6506849-B1 Natural or synthetic rubber; maleimide compound; and polyaniline, hydrazide and/or amine compound; workability, elasticity BRIDGESTONE CORPORATION (JP) 2003-01-14 US disclosed
US-20020049294-A1 Rubber composition and heavy duty pneumatic tire using the rubber composition BRIDGESTONE CORPORATION 2002-04-25 US disclosed
EP-1184412-A1 Rubber composition and heavy duty pneumetic tire using the rubber composition Bridgestone Corporation (JP) 2002-03-06 EP disclosed
US-5633356-A RADIOACTIVE INTERMEDIATE METABOLITE FOR USE IN DIAGNOSTIC TESTING KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1997-05-27 US disclosed
US-5623063-A USING CARBON ISOTOPE-LABELLED GLUCOSE AS STARTING MATERIAL KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1997-04-22 US disclosed
US-5618734-A USING A LABELLED CARBON COMPOUND AS AN INTERNAL STANDARD; USEFUL IN DIAGNOSING DIABETES AND KIDNEY DISEASES KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1997-04-08 US disclosed
EP-0645625-A1 3-Deoxyglucosone derivatives and method for determining the same KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-03-29 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-11813596-B2 Photocatalytic system and applications thereof HCCS, CRY1, PCBP1 RAB9A 4237/4885SMN1; SMN2 3933/4885NPC1 4777/4885
US-20240101510-A1 APYRASE INHIBITORS APEH, DPEP1, PON1 RAB9A 1387/4885SMN1; SMN2 4511/4885NPC1 2564/4885

“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.