SCHEMBL4990505

SCHEMBL4990505

O=c1cn[nH]c2cc3c(cc12)OCO3

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.47
MAPK10 P53779 1/20 0.47
RIPK1 Q13546 1/20 0.47
NPC1 O15118 1/20 0.43
MTOR P42345 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
SCHEMBL3532098 0.76 CHEK1 (0.50) PIM3MAPK10RIPK1
SCHEMBL11150107 0.71 NOS1 (0.41)
SCHEMBL239399 0.70 ALDH1A1 (0.49) NPC1MTOR
SCHEMBL9425210 0.67 ALDH1A1 (0.49) NPC1
SCHEMBL24392413 0.67 KDM4E (0.53) MAPK10RIPK1
SCHEMBL29588761 0.67 KDM4E (0.53) MAPK10RIPK1
SCHEMBL3974738 0.66 DAO (0.33)
SCHEMBL9182150 0.66 NPC1 (0.49) NPC1MTOR
SCHEMBL11433959 0.66 KDM4E (0.51) NPC1MTOR
SCHEMBL17030860 0.66 GRIN2D (0.50)

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-20260033494-A1 PLANT ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE THEREOF TEXAS A & M UNIV SYS (US) 2026-02-05 US disclosed
US-7468366-B2 Cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2008-12-23 US disclosed
EP-1453812-B1 CYTOTOXIC AGENTS UNIV RUTGERS (US) 2008-08-20 EP disclosed
US-20080090831-A1 CYTOTOXIC AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2008-04-17 US disclosed
US-7319105-B2 Methylenedioxy-fused heterocycles, especially 8,10-dioxa-4,5,6,12-tetraaza-cyclopenta[b]chrysen-13-ones; 8,10-dioxa-1,4,5,6,12-pentaaza-cyclopenta[b]chrysen-13-ones; 8,10,12-trioxa-5,6-diaza-cyclopenta[b]chrysenes; and 8,10,12-trioxa-6-aza-cyclopenta[b]chrysenes; topoisomerase inhibitors; treating cancer RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2008-01-15 US disclosed
US-20050009825-A1 Cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2005-01-13 US disclosed
EP-1453812-A2 CYTOTOXIC AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2004-09-08 EP disclosed
WO-2003041653-A2 CYTOTOXIC AGENTS RUTGERS, THE STATE UNIVERSITY (US) 2003-05-22 WO disclosed
US-4495351-A FOR UROGENVITAL DISORDERS VEB ARZNEIMITTELWERK DRESDEN (DD) 1985-01-22 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 (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-20260033494-A1 PLANT ANTIMICROBIAL COMPOSITIONS AND METHODS OF USE THEREOF MYB, DDT, PDE1C PIM3 2103/4885MAPK10 2135/4885RIPK1 2368/4885
US-20050009825-A1 Cytotoxic agents TOP1, TOP2A, TOP2B PIM3 1954/4885MAPK10 3976/4885RIPK1 3643/4885
US-20080090831-A1 CYTOTOXIC AGENTS TOP1, TOP2A, TOP2B PIM3 1954/4885MAPK10 3976/4885RIPK1 3643/4885

“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.