SCHEMBL3260665

SCHEMBL3260665

O=C(C=Cc1cccc(C(F)(F)F)c1)CCN1CCOCC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 3/20 0.67
▸ KEAP1 Q14145 2/20 0.62
▸ NFE2L2 Q16236 2/20 0.62
▸ KMT2A Q03164 2/20 0.54
▸ EPHX2 P34913 1/20 0.47
▸ LMNA P02545 3/20 0.47
▸ P4HB P07237 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MAOB P27338 2/20 0.46
▸ MAOA P21397 1/20 0.46
▸ TRPV4 Q9HBA0 2/20 0.44
▸ CASR P41180 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
SCHEMBL11123877 1.00 HSP90AA1 (0.67) HSP90AA1KEAP1NFE2L2KMT2AEPHX2
Hydrochloric Acid SCHEMBL11125583 0.99 HSP90AA1 (0.69) HSP90AA1KEAP1NFE2L2KMT2AEPHX2
Hydrochloric Acid SCHEMBL11125584 0.99 HSP90AA1 (0.69) HSP90AA1KEAP1NFE2L2KMT2AEPHX2
SCHEMBL782305 0.81 HSP90AA1 (0.97) HSP90AA1KMT2ALMNAMEN1MAPT
SCHEMBL782304 0.81 HSP90AA1 (0.97) HSP90AA1KMT2ALMNAMEN1MAPT
Hydrochloric Acid SCHEMBL11197137 0.80 HSP90AA1 (1.00) HSP90AA1KMT2ALMNAMEN1MAPT
Hydrochloric Acid SCHEMBL11197135 0.80 HSP90AA1 (1.00) HSP90AA1KMT2ALMNAMEN1MAPT
SCHEMBL12125729 0.77 KMT2A (0.64) KMT2AEPHX2LMNAMEN1MAPT
SCHEMBL780480 0.76 HSP90AA1 (0.65) HSP90AA1KMT2ALMNAMAPT
SCHEMBL780481 0.76 HSP90AA1 (0.65) HSP90AA1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250041255-A1 COMPOSITIONS AND METHODS FOR TREATING AUTOIMMUNE SKIN DISEASES YALE UNIVERSITY 2025-02-06 — — US disclosed
US-10881656-B2 HIF inhibitors and use thereof THE GENERAL HOSPITAL CORPORATION (US) 2021-01-05 — — US disclosed
US-20170157111-A1 HIF INHIBITORS AND USE THEREOF THE GENERAL HOSPITAL CORPORATION (US) 2017-06-08 — — US disclosed
US-9604958-B2 HIF inhibitors and use thereof THE GENERAL HOSPITAL CORPORATION (US) 2017-03-28 — — US disclosed
US-20150023868-A1 HIF INHIBITORS AND USE THEREOF THE GENERAL HOSPITAL CORPORATION (US) 2015-01-22 — — US disclosed
WO-2010068794-A2 HIF INHIBITORS AND USE THEREOF THE GENERAL HOSPITAL CORPORATION (US) 2010-06-17 — — WO disclosed
EP-0043141-B1 PHARMACEUTICAL COMPOSITIONS HAVING ANTIVIRAL ACTIVITY FOR TOPICAL ADMINISTRATION AND THE USE OF 1-(SUBSTITUTED PHENYL)-5-(4-MORPHOLINYL)-1-PENTEN-3-ONE COMPOUNDS FOR THE PREPARATION OF PHARMACEUTICAL COMPOSITIONS HAVING AN ANTIVIRAL EFFECT MERRELL DOW PHARMACEUTICALS INC. (US) 1984-09-12 — — EP disclosed
US-4400380-A HERBES VIRUS; TOPICAL MERRELL DOW PHARMACEUTICALS INC. (US) 1983-08-23 — — US disclosed
EP-0043141-A1 Pharmaceutical compositions having antiviral activity for topical administration and the use of 1-(substituted phenyl)-5-(4-morpholinyl)-1-penten-3-one compounds for the preparation of pharmaceutical compositions having an antiviral effect MERRELL DOW PHARMACEUTICALS INC. (US) 1982-01-06 — — 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 (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-10881656-B2 HIF inhibitors and use thereof HIF1AN, HIF1A, EGLN3 HSP90AA1 110/4885KEAP1 64/4885NFE2L2 11/4885
US-20150023868-A1 HIF INHIBITORS AND USE THEREOF HIF1AN, HIF1A, EGLN3 HSP90AA1 110/4885KEAP1 64/4885NFE2L2 11/4885
US-20250041255-A1 COMPOSITIONS AND METHODS FOR TREATING AUTOIMMUNE SKIN DISEASES HIF1AN, HIF1A, SSB HSP90AA1 918/4885KEAP1 1537/4885NFE2L2 467/4885
US-20170157111-A1 HIF INHIBITORS AND USE THEREOF HIF1AN, HIF1A, EGLN3 HSP90AA1 110/4885KEAP1 64/4885NFE2L2 11/4885

“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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