SCHEMBL1677341

SCHEMBL1677341

O=C(Oc1ccccc1)C1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 2/20 0.58
▸ KMT2A Q03164 6/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ HTT P42858 2/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ POLB P06746 2/20 0.54
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ RAB9A P51151 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ GAA P10253 1/20 0.41
▸ RIPK1 Q13546 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ F2 P00734 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
SCHEMBL7659597 0.90 ELANE (0.51) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL3079124 0.87 ELANE (0.73) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12642500 0.87 ELANE (0.73) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL12370828 0.87 ELANE (0.73) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL3193624 0.87 ELANE (0.73) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL525974 0.87 ELANE (0.73) ELANEKMT2ASMN1; SMN2HTTTDP1
Hydrochloric Acid SCHEMBL3866426 0.85 ELANE (0.71) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL28749555 0.84 ELANE (0.50) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL10778406 0.83 KMT2A (0.81) ELANEKMT2ASMN1; SMN2HTTTDP1
SCHEMBL30877928 0.83 KMT2A (0.74) ELANEKMT2ASMN1; SMN2HTTTDP1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661620-A Steroid compound and application thereof 润尔眼科药物(广州)有限公司 2025-03-21 — — CN disclosed
US-20240132479-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2024-04-25 — — US disclosed
EP-1921077-B1 AGENT FOR TREATING AND/OR PREVENTING SLEEP DISORDER KYOWA HAKKO KIRIN CO LTD (JP) 2017-07-26 — — EP disclosed
US-7928098-B2 Therapeutic and/or preventive agents for a sleep disorder KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-04-19 — — US disclosed
US-20100280023-A1 THIAZOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 2010-11-04 — — US disclosed
US-20100152162-A1 THERAPEUTIC AND/OR PREVENTIVE AGENTS FOR A SLEEP DISORDER KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-17 — — US disclosed
CN-100432038-C Method for producing nitrile compound, carboxylic acid compound or carboxylic ester compound UBE INDUSTRIES (JP) 2008-11-12 — — CN disclosed
EP-1921077-A1 AGENT FOR TREATING AND/OR PREVENTING SLEEP DISORDER KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-05-14 — — EP disclosed
EP-1894930-A1 THIAZOLE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-03-05 — — EP disclosed
US-7300953-B2 Process for preparing nitrile compound, carboxylic acid compound or carboxylic acid ester compound UBE INDUSTRIES, LTD (JP) 2007-11-27 — — US disclosed
US-20060287541-A1 Subjecting a 4-substituted tetrahydropyran-4-carboxylic acid compound to to decarboxylation in the presence of a metal catalyst for producing 4-substituted tetrahydropyran UBE INDUSTRIES, LTD. (JP) 2006-12-21 — — US disclosed
CN-1852885-A Method for producing nitrile compound, carboxylic acid compound or carboxylic ester compound UBE INDUSTRIES (JP) 2006-10-25 — — CN disclosed
EP-1671937-A1 METHOD FOR PRODUCING NITRILE COMPOUND, CARBOXYLIC ACID COMPOUND OR CARBOXYLATE COMPOUND Ube Industries, Ltd. (JP) 2006-06-21 — — 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 (4 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-20060287541-A1 Subjecting a 4-substituted tetrahydropyran-4-carboxylic acid compound to to decarboxylation in the presence of a metal catalyst for producing 4-substituted tetrahydropyran CBR1, ALDH18A1, ME1 ELANE 960/4885KMT2A 3180/4885SMN1; SMN2 3011/4885
US-20240132479-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF CUTA, DCXR, PLOD3 ELANE 737/4885KMT2A 2269/4885SMN1; SMN2 560/4885
US-20100152162-A1 THERAPEUTIC AND/OR PREVENTIVE AGENTS FOR A SLEEP DISORDER HCRTR1, MTNR1A, HCRTR2 ELANE 2655/4885KMT2A 763/4885SMN1; SMN2 3229/4885
US-20100280023-A1 THIAZOLE DERIVATIVES ADORA2A, ADORA3, GPR6 ELANE 4736/4885KMT2A 3453/4885SMN1; SMN2 4647/4885

“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.

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