SCHEMBL6151444

SCHEMBL6151444

COC(=N)C(C)(C)N=NC(C)(C)C(=N)OC

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
CYP2D6 P10635 1/20 0.43
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL6151442 1.00 ALDH1A1 (0.43) ALDH1A1CYP3A4MAPTCYP2D6CA12
Hydrochloric Acid SCHEMBL6151822 0.97 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTCYP2D6CA12
Hydrochloric Acid SCHEMBL9286549 0.97 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTCYP2D6CA12
Hydrochloric Acid SCHEMBL6151823 0.97 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTCYP2D6CA12
Hydrochloric Acid SCHEMBL9286555 0.97 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTCYP2D6CA12
SCHEMBL22605378 0.80
SCHEMBL11900824 0.71
SCHEMBL6151834 0.70 CA12 (0.40) ALDH1A1CYP3A4MAPTCYP2D6CA12
Hydrochloric Acid SCHEMBL5444600 0.69
Hydrochloric Acid SCHEMBL5444092 0.67

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
JP-11310565-A None JP disclosed
US-20200309782-A1 INTRACELLULAR DELIVERY VEHICLE KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2020-10-01 US disclosed
US-10712346-B2 Intracellular delivery vehicle KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2020-07-14 US disclosed
US-20190137503-A1 INTRACELLULAR DELIVERY VEHICLE KIRIN KABUSHIKI KAISHA (JP) 2019-05-09 US disclosed
EP-1195376-B1 Azoamidine compounds and their use as polymerization initiators WAKO PURE CHEMICAL INDUSTIES L (JP) 2005-02-02 EP disclosed
US-6403774-B1 WATER SOLUBLE POLYMERIZATION INITIATOR. WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US disclosed
US-20020062012-A1 Novel azoamidine compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-05-23 US disclosed
EP-1195376-A1 Azoamidine compounds and their use as polymerization initiators Wako Pure Chemical Industies, Ltd. (JP) 2002-04-10 EP disclosed
JP-H11310565-A NEW AZOAMIDINE COMPOUND WAKO PURE CHEM IND LTD 1999-11-09 JP 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 (3 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-10712346-B2 Intracellular delivery vehicle CHERP, ACTB, GOLT1B ALDH1A1 4647/4885CYP3A4 4860/4885MAPT 1992/4885
US-20200309782-A1 INTRACELLULAR DELIVERY VEHICLE CHERP, ACTB, GOLT1B ALDH1A1 4647/4885CYP3A4 4860/4885MAPT 1992/4885
US-20190137503-A1 INTRACELLULAR DELIVERY VEHICLE CHERP, ACTB, GOLT1B ALDH1A1 4647/4885CYP3A4 4860/4885MAPT 1992/4885

“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.