SCHEMBL4243171

SCHEMBL4243171

O=NC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.39
SHBG P04278 1/20 0.36
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL9416347 0.77 EPHX1 (0.39) EPHX1SHBGTP53KDM4EGMNN
SCHEMBL939785 0.70 ALDH1A1 (0.42) EPHX1SHBGTP53ALDH1A1
SCHEMBL2768891 0.70 ALDH1A1 (0.42) EPHX1SHBGTP53ALDH1A1
SCHEMBL28571200 0.66 ALDH1A1 (0.38) EPHX1ALDH1A1
SCHEMBL995374 0.65 EPHX1 (0.32) EPHX1SHBGTP53
SCHEMBL28416887 0.65 EPHX1 (0.32) EPHX1SHBGTP53
SCHEMBL331898 0.65 EPHX1 (0.32) EPHX1SHBGTP53
SCHEMBL2844353 0.65 EPHX1 (0.43) EPHX1SHBGTP53KDM4EGMNN
Iodide SCHEMBL28876916 0.64 EPHX1 (0.31) EPHX1SHBG
SCHEMBL3227070 0.63 EPHX1 (0.45) EPHX1SHBGTP53KDM4EGMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070269379-A1 Penetration Enhancer Combinations for Transdermal Delivery REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2007-11-22 US claimed
WO-2005009510-A2 PENETRATION ENHANCER COMBINATIONS FOR TRANSDERMAL DELIVERY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-02-03 WO claimed
US-4411893-A ENHANCED SKIN PENETRATION, WATER-SOLUBLE TERTIARY AMINE OXIDES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-10-25 US claimed
EP-3324930-B1 DELIVERY OF DRUG NANOPARTICLES AND METHODS OF USE THEREOF DFB SORIA LLC (US) 2025-09-17 EP disclosed
US-12329858-B2 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer CRITITECH, INC. (US) 2025-06-17 US disclosed
CN-118948828-A Topical treatment of cutaneous malignant tumors using taxane nanoparticles DFB索里亚有限责任公司 2024-11-15 CN disclosed
CN-118649239-A Topical delivery of anti-tumor particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer 克里蒂泰克公司 2024-09-17 CN disclosed
US-20240252441-A1 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer CRITITECH, INC. 2024-08-01 US disclosed
CN-110636833-B Topical treatment of cutaneous malignant tumors using taxane nanoparticles DFB索里亚有限责任公司 2024-07-09 CN disclosed
US-11918691-B2 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer CRITITECH, INC. (US) 2024-03-05 US disclosed
US-20230263731-A1 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer CRITITECH, INC. 2023-08-24 US disclosed
US-6217852-B1 APPLYING DURING WASHING; SUNSCREEN AGENT SKINNOVATIVE DERMATOLOGIC CONCEPTS, L.L.C. 2001-04-17 US disclosed
WO-2000009081-A1 PERSONAL CLEANSING COMPOSITIONS HAVING PHOTOPROTECTIVE AGENTS SKINNOVATIVE DERMATOLOGIC CONCEPTS, L.L.C. (US) 2000-02-24 WO disclosed
US-5731303-A MACROCYCLIC COMPOUNDS ENHANCE DRUG ABSORPTION ACROSS BLOOD-BRAIN BARRIER CONREX PHARMACEUTICAL CORPORATION (US) 1998-03-24 US disclosed
EP-0248885-B1 TRANSDERMAL DELIVERY OF DRUGS HSIEH, Dean (US) 1992-08-05 EP disclosed
US-5023252-A Using heterocyclic oxygen, sulfur, or nitrogen containing compound CONREX PHARMACEUTICAL CORPORATION (US) 1991-06-11 US disclosed
EP-0248885-A4 TRANSDERMAL DELIVERY OF DRUGS. HSIEH DEAN 1988-05-16 EP disclosed
EP-0248885-A1 TRANSDERMAL DELIVERY OF DRUGS. HSIEH DEAN 1987-12-16 EP disclosed
WO-1987003473-A1 TRANSDERMAL DELIVERY OF DRUGS HSIEH DEAN 1987-06-18 WO disclosed
US-4411893-A ENHANCED SKIN PENETRATION, WATER-SOLUBLE TERTIARY AMINE OXIDES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-10-25 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 (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-12329858-B2 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer TP53, IPO5, NUP205 EPHX1 2766/4885SHBG 2077/4885TP53 1/4885
US-11918691-B2 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer ARID2, ACIN1, TP53 EPHX1 3452/4885SHBG 3271/4885TP53 3/4885
US-20230263731-A1 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer ARID2, ACIN1, TP53 EPHX1 3452/4885SHBG 3271/4885TP53 3/4885
US-20240252441-A1 Local delivery of antineoplastic particles in combination with systemic delivery of immunotherapeutic agents for the treatment of cancer TP53, IPO5, NUP205 EPHX1 2766/4885SHBG 2077/4885TP53 1/4885

“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.