SCHEMBL5023992

SCHEMBL5023992

COc1cc(CN2CCN(CCCCCC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 1.00
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL5026282 1.00 KCNH2 (1.00) KCNH2KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL5024071 0.90 KCNH2 (0.82) KCNH2KDM4EALDH1A1SMN1; SMN2
SCHEMBL5024011 0.89 KCNH2 (0.80) KCNH2KDM4EALDH1A1SMN1; SMN2
SCHEMBL5023984 0.87 KCNH2 (0.76) KCNH2
SCHEMBL5024658 0.86 KCNH2 (1.00) KCNH2
SCHEMBL5026271 0.86 KCNH2 (0.75) KCNH2KDM4EALDH1A1HTT
SCHEMBL5027802 0.85 KCNH2 (0.74) KCNH2ALDH1A1SMN1; SMN2
SCHEMBL5076819 0.85 KCNH2 (0.77) KCNH2KDM4EALDH1A1HTT
SCHEMBL5017386 0.85 KCNH2 (0.74) KCNH2KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL8302796 0.85 KCNH2 (0.73) KCNH2KDM4EALDH1A1HTT

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
US-20250152568-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. 2025-05-15 US claimed
EP-4475887-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME Aisa Pharma, Inc. (US) 2024-12-18 EP claimed
WO-2024211216-A1 CILNIDIPINE AND A P-GLYCOPROTEIN INHIBITOR FOR TREATING PAIN AISA PHARMA, INC. (US) 2024-10-10 WO claimed
WO-2023150336-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. (US) 2023-08-10 WO claimed
US-20080300262-A1 Combination Therapy for Relief of Pain ZALICUS PHARMACEUTICALS LTD. (CA) 2008-12-04 US claimed
EP-1871372-A1 COMBINATION THERAPY COMPRISING AN N-TYPE CALCIUM CHANNEL BLOCKER FOR THE ALLEVIATION OF PAIN Neuromed Pharmaceuticals, Ltd. (CA) 2008-01-02 EP claimed
WO-2006105670-A1 COMBINATION THERAPY COMPRISING AN N-TYPE CALCIUM CHANNEL BLOCKER FOR THE ALLEVIATION OF PAIN NEUROMED PHARMACEUTICALS LTD. (CA) 2006-10-12 WO claimed
EP-4683634-A1 TREATMENT OF SCLERODERMA Aisa Pharma, Inc. (US) 2026-01-28 EP disclosed
US-20250152568-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME AISA PHARMA, INC. 2025-05-15 US disclosed
EP-4523748-A2 TREATMENT OF PAIN AND VASOCONSTRICTION Aisa Pharma, Inc. (US) 2025-03-19 EP disclosed
EP-4475887-A1 METHODS OF TREATING COMPLEX REGIONAL PAIN SYNDROME Aisa Pharma, Inc. (US) 2024-12-18 EP disclosed
US-20240398771-A1 TREATMENT OF SCLERODERMA AND RAYNAUD'S SYNDROME AISA PHARMA, INC. 2024-12-05 US disclosed
EP-4114466-B1 TREATMENT OF PAIN AND VASOCONSTRICTION AISA PHARMA INC (US) 2024-12-04 EP disclosed
WO-2022115576-A2 TREATMENT OF RAYNAUD'S DISEASE AISA PHARMA, INC. (US) 2022-06-02 WO disclosed
US-20220168286-A1 TREATMENT OF RAYNAUD'S DISEASE AISA PHARMA, INC. 2022-06-02 US disclosed
US-20090012095-A1 HUMAN N-TYPE CALCIUM CHANNEL BLOCKERS WYETH (US) 2009-01-08 US disclosed
US-20090012095-A1 HUMAN N-TYPE CALCIUM CHANNEL BLOCKERS WYETH (US) 2009-01-08 US disclosed
US-20080300262-A1 Combination Therapy for Relief of Pain ZALICUS PHARMACEUTICALS LTD. (CA) 2008-12-04 US disclosed
EP-1871372-A1 COMBINATION THERAPY COMPRISING AN N-TYPE CALCIUM CHANNEL BLOCKER FOR THE ALLEVIATION OF PAIN Neuromed Pharmaceuticals, Ltd. (CA) 2008-01-02 EP disclosed
WO-2006105670-A1 COMBINATION THERAPY COMPRISING AN N-TYPE CALCIUM CHANNEL BLOCKER FOR THE ALLEVIATION OF PAIN NEUROMED PHARMACEUTICALS LTD. (CA) 2006-10-12 WO 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-20090012095-A1 HUMAN N-TYPE CALCIUM CHANNEL BLOCKERS CACNA1B, CACNA1G, CACNA1F KCNH2 80/4885KDM4E 3959/4885ALDH1A1 4336/4885
US-20080300262-A1 Combination Therapy for Relief of Pain CACNA1B, TRPV1, ORAI1 KCNH2 109/4885KDM4E 3858/4885ALDH1A1 4513/4885

“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.